Organic sulfonic acids and derivatives

Organic compounds that consist of sulfonic acid with organic functional group substitutions; includes compounds that are derived from organic sulfonic acids.

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1-Heptanesulfonic Acid Sodium Salt (HPLC), Fisher Chemical™

CAS: 22767-50-6 Molecular Formula: C7H15NaO3S MDL Number: MFCD00007543 InChI Key: REFMEZARFCPESH-UHFFFAOYSA-M PubChem CID: 23672332

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PubChem CID	23672332
CAS	22767-50-6
MDL Number	MFCD00007543
InChI Key	REFMEZARFCPESH-UHFFFAOYSA-M
Molecular Formula	C7H15NaO3S

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1-Hexanesulfonic Acid Sodium Salt (HPLC), Fisher Chemical™

CAS: 2832-45-3 Molecular Formula: C6H13NaO3S Molecular Weight (g/mol): 188.22 MDL Number: MFCD00007542 InChI Key: QWSZRRAAFHGKCH-UHFFFAOYSA-M Synonym: sodium 1-hexanesulfonate,sodium hexane-1-sulfonate,sodium hexanesulfonate,1-hexanesulfonic acid sodium salt,1-hexanesulfonic acid, sodium salt,1-hexanesulfonic acid, sodium salt 1:1,1-hexane sulfonic acid sodium salt,hexyl sodium sulfonate,1-hexanesulfonate, sodium,hexanesulfonic acid na-salt PubChem CID: 23677630 IUPAC Name: sodium hexane-1-sulfonate SMILES: [Na+].CCCCCCS([O-])(=O)=O

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PubChem CID	23677630
CAS	2832-45-3
Molecular Weight (g/mol)	188.22
MDL Number	MFCD00007542
SMILES	[Na+].CCCCCCS([O-])(=O)=O
Synonym	sodium 1-hexanesulfonate,sodium hexane-1-sulfonate,sodium hexanesulfonate,1-hexanesulfonic acid sodium salt,1-hexanesulfonic acid, sodium salt,1-hexanesulfonic acid, sodium salt 1:1,1-hexane sulfonic acid sodium salt,hexyl sodium sulfonate,1-hexanesulfonate, sodium,hexanesulfonic acid na-salt
IUPAC Name	sodium hexane-1-sulfonate
InChI Key	QWSZRRAAFHGKCH-UHFFFAOYSA-M
Molecular Formula	C6H13NaO3S

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1-Pentanesulfonic Acid Sodium Salt, Anhydrous (HPLC), Fisher Chemical

CAS: 22767-49-3 Molecular Formula: C5H11NaO3S Molecular Weight (g/mol): 174.19 MDL Number: MFCD00007541,MFCD00149548 InChI Key: ROBLTDOHDSGGDT-UHFFFAOYSA-M Synonym: sodium 1-pentanesulfonate,sodium pentane-1-sulfonate,sodium pentanesulfonate,1-pentanesulfonic acid sodium salt,1-pentanesulfonic acid, sodium salt,1-pentylsodiumsulfonate,ipc-alks-5,1-pentanesulfonate, sodium,pentanesulfonic acid na-salt,pentanesulfonic acidsodiumsalt PubChem CID: 23664617 IUPAC Name: sodium pentane-1-sulfonate SMILES: [Na+].CCCCCS([O-])(=O)=O

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PubChem CID	23664617
CAS	22767-49-3
Molecular Weight (g/mol)	174.19
MDL Number	MFCD00007541,MFCD00149548
SMILES	[Na+].CCCCCS([O-])(=O)=O
Synonym	sodium 1-pentanesulfonate,sodium pentane-1-sulfonate,sodium pentanesulfonate,1-pentanesulfonic acid sodium salt,1-pentanesulfonic acid, sodium salt,1-pentylsodiumsulfonate,ipc-alks-5,1-pentanesulfonate, sodium,pentanesulfonic acid na-salt,pentanesulfonic acidsodiumsalt
IUPAC Name	sodium pentane-1-sulfonate
InChI Key	ROBLTDOHDSGGDT-UHFFFAOYSA-M
Molecular Formula	C5H11NaO3S

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1 Octane Sulfonic Acid Sodium Salt, HPLC Ion Pair Agent, Fisher Chemical™

CAS: 5324-84-5 Molecular Formula: C8H17NaO3S Molecular Weight (g/mol): 216.27 MDL Number: MFCD00007544 InChI Key: HRQDCDQDOPSGBR-UHFFFAOYSA-M IUPAC Name: sodium octane-1-sulfonate SMILES: [Na+].CCCCCCCCS([O-])(=O)=O

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CAS	5324-84-5
Molecular Weight (g/mol)	216.27
MDL Number	MFCD00007544
SMILES	[Na+].CCCCCCCCS([O-])(=O)=O
IUPAC Name	sodium octane-1-sulfonate
InChI Key	HRQDCDQDOPSGBR-UHFFFAOYSA-M
Molecular Formula	C8H17NaO3S

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Sulfanilic Acid Anhydrous (Crystalline/Certified ACS), Fisher Chemical

CAS: 121-57-3 Molecular Formula: C6H7NO3S Molecular Weight (g/mol): 173.186 MDL Number: MFCD00007886 InChI Key: HVBSAKJJOYLTQU-UHFFFAOYSA-N Synonym: sulfanilic acid,sulphanilic acid,p-aminobenzenesulfonic acid,sulfanilsaeure,aniline-4-sulfonic acid,benzenesulfonic acid, 4-amino,aniline-p-sulfonic acid,aniline-p-sulphonic acid,p-aminophenylsulfonic acid,sulfanilicacid PubChem CID: 8479 ChEBI: CHEBI:27500 IUPAC Name: 4-aminobenzenesulfonic acid SMILES: C1=CC(=CC=C1N)S(=O)(=O)O

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PubChem CID	8479
CAS	121-57-3
Molecular Weight (g/mol)	173.186
ChEBI	CHEBI:27500
MDL Number	MFCD00007886
SMILES	C1=CC(=CC=C1N)S(=O)(=O)O
Synonym	sulfanilic acid,sulphanilic acid,p-aminobenzenesulfonic acid,sulfanilsaeure,aniline-4-sulfonic acid,benzenesulfonic acid, 4-amino,aniline-p-sulfonic acid,aniline-p-sulphonic acid,p-aminophenylsulfonic acid,sulfanilicacid
IUPAC Name	4-aminobenzenesulfonic acid
InChI Key	HVBSAKJJOYLTQU-UHFFFAOYSA-N
Molecular Formula	C6H7NO3S

LiChropur™ Sodium 1-pentanesulfonate monohydrate , ≥99.0% (T), MilliporeSigma™ Supelco™

MDL Number: MFCD00149548 Synonym: 1-Pentanesulfonic acid sodium salt

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MDL Number	MFCD00149548
Synonym	1-Pentanesulfonic acid sodium salt

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Pyridine-3-sulfonic acid, 98+%

CAS: 636-73-7 Molecular Formula: C5H4NO3S Molecular Weight (g/mol): 158.15 MDL Number: MFCD00006381 InChI Key: DVECLMOWYVDJRM-UHFFFAOYSA-M Synonym: 3-pyridinesulfonic acid,pyridine-3-sulphonic acid,3-pyridylsulfonic acid,3-pyridine sulfonic acid,3-sulfopyridine,beta-sulfopyridine,3-pyridinesulfonicacid,pubchem9608,pyridin-3-sulfonic acid,acmc-209nh7 PubChem CID: 69468 SMILES: [O-]S(=O)(=O)C1=CC=CN=C1

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PubChem CID	69468
CAS	636-73-7
Molecular Weight (g/mol)	158.15
MDL Number	MFCD00006381
SMILES	[O-]S(=O)(=O)C1=CC=CN=C1
Synonym	3-pyridinesulfonic acid,pyridine-3-sulphonic acid,3-pyridylsulfonic acid,3-pyridine sulfonic acid,3-sulfopyridine,beta-sulfopyridine,3-pyridinesulfonicacid,pubchem9608,pyridin-3-sulfonic acid,acmc-209nh7
InChI Key	DVECLMOWYVDJRM-UHFFFAOYSA-M
Molecular Formula	C5H4NO3S

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Aluminum trifluoromethanesulfonate, 99%

CAS: 74974-61-1 Molecular Formula: C3AlF9O9S3 Molecular Weight (g/mol): 474.171 MDL Number: MFCD00143596 InChI Key: FKOASGGZYSYPBI-UHFFFAOYSA-K Synonym: aluminum trifluoromethanesulfonate,aluminum triflate,aluminum triflate,aluminum tris trifluoromethanesulfonate,aluminum trifluoromethanesulphonate,aluminum 3+ tritriflate,aluminum trifluoromethanesulfonate,aluminum iii triflate,aluminum iii triflate,aluminum tris fluoranyl methanesulfonate PubChem CID: 2737634 IUPAC Name: aluminum;trifluoromethanesulfonate SMILES: C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[Al+3]

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PubChem CID	2737634
CAS	74974-61-1
Molecular Weight (g/mol)	474.171
MDL Number	MFCD00143596
SMILES	C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[Al+3]
Synonym	aluminum trifluoromethanesulfonate,aluminum triflate,aluminum triflate,aluminum tris trifluoromethanesulfonate,aluminum trifluoromethanesulphonate,aluminum 3+ tritriflate,aluminum trifluoromethanesulfonate,aluminum iii triflate,aluminum iii triflate,aluminum tris fluoranyl methanesulfonate
IUPAC Name	aluminum;trifluoromethanesulfonate
InChI Key	FKOASGGZYSYPBI-UHFFFAOYSA-K
Molecular Formula	C3AlF9O9S3

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2,2,2-Trifluoroethyl p-toluenesulfonate, 98+%

CAS: 433-06-7 Molecular Formula: C9H9F3O3S Molecular Weight (g/mol): 254.223 MDL Number: MFCD00000443 InChI Key: IGKCQDUYZULGBM-UHFFFAOYSA-N Synonym: 2,2,2-trifluoroethyl p-toluenesulfonate,2,2,2-trifluoroethyl tosylate,trifluoroethanol tosylate,trifluorethyltosylate,2,2,2-trifluoroethyl-p-toluenesulfonate,ethanol, 2,2,2-trifluoro-, 4-methylbenzenesulfonate,2,2,2-trifluoroethyl p-toluenesulphonate,ethanol, 2,2,2-trifluoro-, p-toluenesulfonate,2,2,2-trifluoroethyl 4-methylbenzene-1-sulfonate,ethanol, 2,2,2-trifluoro-, 1-4-methylbenzenesulfonate PubChem CID: 67942 IUPAC Name: 2,2,2-trifluoroethyl 4-methylbenzenesulfonate SMILES: CC1=CC=C(C=C1)S(=O)(=O)OCC(F)(F)F

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Specifications

PubChem CID	67942
CAS	433-06-7
Molecular Weight (g/mol)	254.223
MDL Number	MFCD00000443
SMILES	CC1=CC=C(C=C1)S(=O)(=O)OCC(F)(F)F
Synonym	2,2,2-trifluoroethyl p-toluenesulfonate,2,2,2-trifluoroethyl tosylate,trifluoroethanol tosylate,trifluorethyltosylate,2,2,2-trifluoroethyl-p-toluenesulfonate,ethanol, 2,2,2-trifluoro-, 4-methylbenzenesulfonate,2,2,2-trifluoroethyl p-toluenesulphonate,ethanol, 2,2,2-trifluoro-, p-toluenesulfonate,2,2,2-trifluoroethyl 4-methylbenzene-1-sulfonate,ethanol, 2,2,2-trifluoro-, 1-4-methylbenzenesulfonate
IUPAC Name	2,2,2-trifluoroethyl 4-methylbenzenesulfonate
InChI Key	IGKCQDUYZULGBM-UHFFFAOYSA-N
Molecular Formula	C9H9F3O3S

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2-Naphthyl trifluoromethanesulfonate, 97%, Thermo Scientific™

CAS: 3857-83-8 Molecular Formula: C11H7F3O3S Molecular Weight (g/mol): 276.229 MDL Number: MFCD00192341 InChI Key: MDWRQYBWVTXIIJ-UHFFFAOYSA-N Synonym: 2-naphthyl trifluoromethanesulfonate,2-naphthyl triflate,2-naphthyltrifluoromethanesulfonate,2-naphthyltriflate,acmc-1aigh,trifluoromethanesulfonic acid 2-naphthyl ester,methanesulfonic acid, 1,1,1-trifluoro-, 2-naphthalenyl ester,methanesulfonic acid,1,1,1-trifluoro-, 2-naphthalenyl ester PubChem CID: 4546341 IUPAC Name: naphthalen-2-yl trifluoromethanesulfonate SMILES: C1=CC=C2C=C(C=CC2=C1)OS(=O)(=O)C(F)(F)F

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Specifications

PubChem CID	4546341
CAS	3857-83-8
Molecular Weight (g/mol)	276.229
MDL Number	MFCD00192341
SMILES	C1=CC=C2C=C(C=CC2=C1)OS(=O)(=O)C(F)(F)F
Synonym	2-naphthyl trifluoromethanesulfonate,2-naphthyl triflate,2-naphthyltrifluoromethanesulfonate,2-naphthyltriflate,acmc-1aigh,trifluoromethanesulfonic acid 2-naphthyl ester,methanesulfonic acid, 1,1,1-trifluoro-, 2-naphthalenyl ester,methanesulfonic acid,1,1,1-trifluoro-, 2-naphthalenyl ester
IUPAC Name	naphthalen-2-yl trifluoromethanesulfonate
InChI Key	MDWRQYBWVTXIIJ-UHFFFAOYSA-N
Molecular Formula	C11H7F3O3S

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Hydroxylamine-O-sulfonic acid, 97%

CAS: 2950-43-8 Molecular Formula: H3NO4S Molecular Weight (g/mol): 113.09 MDL Number: MFCD00011604 InChI Key: DQPBABKTKYNPMH-UHFFFAOYSA-N Synonym: hydroxylamine-o-sulfonic acid,aminooxy sulfonic acid,sulfoperamidic acid,hydroxylamine-o-sulphonic acid,permonosulfamic acid,amidoperoxymonosulfuric acid,aminooxysulfonic acid,amidosulfonic peracid,haos,sulfamic acid n-oxide PubChem CID: 76284 IUPAC Name: amino hydrogen sulfate SMILES: NOS(O)(=O)=O

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PubChem CID	76284
CAS	2950-43-8
Molecular Weight (g/mol)	113.09
MDL Number	MFCD00011604
SMILES	NOS(O)(=O)=O
Synonym	hydroxylamine-o-sulfonic acid,aminooxy sulfonic acid,sulfoperamidic acid,hydroxylamine-o-sulphonic acid,permonosulfamic acid,amidoperoxymonosulfuric acid,aminooxysulfonic acid,amidosulfonic peracid,haos,sulfamic acid n-oxide
IUPAC Name	amino hydrogen sulfate
InChI Key	DQPBABKTKYNPMH-UHFFFAOYSA-N
Molecular Formula	H3NO4S

Sodium 1-dodecanesulfonate, 99%

CAS: 2386-53-0 Molecular Formula: C12H25NaO3S Molecular Weight (g/mol): 272.379 MDL Number: MFCD00007527 InChI Key: DAJSVUQLFFJUSX-UHFFFAOYSA-M Synonym: sodium 1-dodecanesulfonate,sodium dodecane-1-sulfonate,1-dodecanesulfonic acid sodium salt,sodium laurylsulfonate,1-dodecanesulfonic acid, sodium salt,unii-4gy1kjw8si,sodium dodecyl sulfonate,4gy1kjw8si,laurylsulfonic acid sodium salt,1-dodecanesulfonic acid, sodium salt 1:1 PubChem CID: 23665726 IUPAC Name: sodium;dodecane-1-sulfonate SMILES: CCCCCCCCCCCCS(=O)(=O)[O-].[Na+]

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Specifications

PubChem CID	23665726
CAS	2386-53-0
Molecular Weight (g/mol)	272.379
MDL Number	MFCD00007527
SMILES	CCCCCCCCCCCCS(=O)(=O)[O-].[Na+]
Synonym	sodium 1-dodecanesulfonate,sodium dodecane-1-sulfonate,1-dodecanesulfonic acid sodium salt,sodium laurylsulfonate,1-dodecanesulfonic acid, sodium salt,unii-4gy1kjw8si,sodium dodecyl sulfonate,4gy1kjw8si,laurylsulfonic acid sodium salt,1-dodecanesulfonic acid, sodium salt 1:1
IUPAC Name	sodium;dodecane-1-sulfonate
InChI Key	DAJSVUQLFFJUSX-UHFFFAOYSA-M
Molecular Formula	C12H25NaO3S

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1,3-Propanediol di-p-toluenesulfonate, 98%, Thermo Scientific Chemicals

CAS: 5469-66-9 Molecular Formula: C17H20O6S2 Molecular Weight (g/mol): 384.46 MDL Number: MFCD00013392 InChI Key: ODVREDGIWSDQFD-UHFFFAOYSA-N Synonym: 1,3-bis tosyloxy propane,propane-1,3-diyl bis 4-methylbenzenesulfonate,1,3-propanediol di-p-toluenesulfonate,1,3-propanediol di-p-tosylate,1,3-propanediol-di-4-tosylate,3-4-methylbenzenesulfonyl oxy propyl 4-methylbenzene-1-sulfonate,3-4-methylbenzenesulfonyl oxy propyl 4-methylbenzenesulfonate,propane-1,3-di-tos,acmc-209liv,1,3-propanediol ditosylate PubChem CID: 230370 IUPAC Name: 3-(4-methylphenyl)sulfonyloxypropyl 4-methylbenzenesulfonate SMILES: CC1=CC=C(C=C1)S(=O)(=O)OCCCOS(=O)(=O)C1=CC=C(C)C=C1

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Specifications

PubChem CID	230370
CAS	5469-66-9
Molecular Weight (g/mol)	384.46
MDL Number	MFCD00013392
SMILES	CC1=CC=C(C=C1)S(=O)(=O)OCCCOS(=O)(=O)C1=CC=C(C)C=C1
Synonym	1,3-bis tosyloxy propane,propane-1,3-diyl bis 4-methylbenzenesulfonate,1,3-propanediol di-p-toluenesulfonate,1,3-propanediol di-p-tosylate,1,3-propanediol-di-4-tosylate,3-4-methylbenzenesulfonyl oxy propyl 4-methylbenzene-1-sulfonate,3-4-methylbenzenesulfonyl oxy propyl 4-methylbenzenesulfonate,propane-1,3-di-tos,acmc-209liv,1,3-propanediol ditosylate
IUPAC Name	3-(4-methylphenyl)sulfonyloxypropyl 4-methylbenzenesulfonate
InChI Key	ODVREDGIWSDQFD-UHFFFAOYSA-N
Molecular Formula	C17H20O6S2

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Propargyl p-toluenesulfonate, 97%

CAS: 6165-76-0 Molecular Formula: C10H10O3S Molecular Weight (g/mol): 210.247 MDL Number: MFCD00078365 InChI Key: LMBVCSFXFFROTA-UHFFFAOYSA-N Synonym: propargyl p-toluenesulfonate,propargyl tosylate,prop-2-yn-1-yl 4-methylbenzenesulfonate,p-toluenesulfonic acid, 2-propynyl ester,2-propyn-1-ol, 4-methylbenzenesulfonate,ccris 9146,p-toluenesulfonic acid propargyl ester,propargylp-toluenesulfonate,propargyl p-toluene sulfonate,acmc-209mv7 PubChem CID: 22547 IUPAC Name: prop-2-ynyl 4-methylbenzenesulfonate SMILES: CC1=CC=C(C=C1)S(=O)(=O)OCC#C

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Specifications

PubChem CID	22547
CAS	6165-76-0
Molecular Weight (g/mol)	210.247
MDL Number	MFCD00078365
SMILES	CC1=CC=C(C=C1)S(=O)(=O)OCC#C
Synonym	propargyl p-toluenesulfonate,propargyl tosylate,prop-2-yn-1-yl 4-methylbenzenesulfonate,p-toluenesulfonic acid, 2-propynyl ester,2-propyn-1-ol, 4-methylbenzenesulfonate,ccris 9146,p-toluenesulfonic acid propargyl ester,propargylp-toluenesulfonate,propargyl p-toluene sulfonate,acmc-209mv7
IUPAC Name	prop-2-ynyl 4-methylbenzenesulfonate
InChI Key	LMBVCSFXFFROTA-UHFFFAOYSA-N
Molecular Formula	C10H10O3S

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Copper(I) trifluoromethanesulfonate toluene complex (2:1), 98%

CAS: 48209-28-5 Molecular Formula: C9H8Cu2F6O6S2 Molecular Weight (g/mol): 517.359 MDL Number: MFCD01863766 InChI Key: ATUUSMBCJWYMEG-UHFFFAOYSA-L Synonym: copper i trifluoromethanesulfonate toluene complex,cuotf-toluene,copper i triflate toluene complex,cuprous trifluoromethanesulfonate toluene complex,trifluoromethanesulfonic acid copper i salt toluene complex,copper i trifluoromethanesulfonate toluene complex 2:1 PubChem CID: 11656500 IUPAC Name: copper(1+);toluene;trifluoromethanesulfonate SMILES: CC1=CC=CC=C1.C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[Cu+].[Cu+]

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Specifications

PubChem CID	11656500
CAS	48209-28-5
Molecular Weight (g/mol)	517.359
MDL Number	MFCD01863766
SMILES	CC1=CC=CC=C1.C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[Cu+].[Cu+]
Synonym	copper i trifluoromethanesulfonate toluene complex,cuotf-toluene,copper i triflate toluene complex,cuprous trifluoromethanesulfonate toluene complex,trifluoromethanesulfonic acid copper i salt toluene complex,copper i trifluoromethanesulfonate toluene complex 2:1
IUPAC Name	copper(1+);toluene;trifluoromethanesulfonate
InChI Key	ATUUSMBCJWYMEG-UHFFFAOYSA-L
Molecular Formula	C9H8Cu2F6O6S2

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