Indoles and derivatives

Aromatic bicyclic organic compounds that consists of a benzene ring fused to a pyrrole ring with formula: C₈H₇N.

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Tryptamine, 98%

CAS: 61-54-1 Molecular Formula: C10H12N2 Molecular Weight (g/mol): 160.22 MDL Number: MFCD00005661 InChI Key: APJYDQYYACXCRM-UHFFFAOYSA-N Synonym: tryptamine,2-1h-indol-3-yl ethanamine,3-2-aminoethyl indole,1h-indole-3-ethanamine,2-3-indolyl ethylamine,indol-3-ethylamine,indole, 3-2-aminoethyl,2-indol-3-yl ethylamine,2-1h-indol-3-yl ethan-1-amine,tryptamin PubChem CID: 1150 ChEBI: CHEBI:16765 IUPAC Name: 2-(1H-indol-3-yl)ethanamine SMILES: NCCC1=CNC2=CC=CC=C12

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Specifications

PubChem CID	1150
CAS	61-54-1
Molecular Weight (g/mol)	160.22
ChEBI	CHEBI:16765
MDL Number	MFCD00005661
SMILES	NCCC1=CNC2=CC=CC=C12
Synonym	tryptamine,2-1h-indol-3-yl ethanamine,3-2-aminoethyl indole,1h-indole-3-ethanamine,2-3-indolyl ethylamine,indol-3-ethylamine,indole, 3-2-aminoethyl,2-indol-3-yl ethylamine,2-1h-indol-3-yl ethan-1-amine,tryptamin
IUPAC Name	2-(1H-indol-3-yl)ethanamine
InChI Key	APJYDQYYACXCRM-UHFFFAOYSA-N
Molecular Formula	C10H12N2

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3-Amino-9-ethylcarbazole, 90%, tech.

CAS: 132-32-1 Molecular Formula: C₁₄H₁₄N₂ Molecular Weight (g/mol): 210.28 MDL Number: MFCD00004964 InChI Key: OXEUETBFKVCRNP-UHFFFAOYSA-N Synonym: 3-amino-9-ethylcarbazole,9-ethyl-9h-carbazol-3-amine,3-amino-n-ethylcarbazole,9h-carbazol-3-amine, 9-ethyl,carbazole, 3-amino-9-ethyl,9-ethylcarbazol-3-ylamine,unii-8q2bg27jbu,9-ethylcarbazole-3-ylamine,8q2bg27jbu,9-ethyl-9h-carbazol-3-ylamine PubChem CID: 8588 IUPAC Name: 9-ethylcarbazol-3-amine SMILES: CCN1C2=C(C=C(C=C2)N)C3=CC=CC=C31

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Specifications

PubChem CID	8588
CAS	132-32-1
Molecular Weight (g/mol)	210.28
MDL Number	MFCD00004964
SMILES	CCN1C2=C(C=C(C=C2)N)C3=CC=CC=C31
Synonym	3-amino-9-ethylcarbazole,9-ethyl-9h-carbazol-3-amine,3-amino-n-ethylcarbazole,9h-carbazol-3-amine, 9-ethyl,carbazole, 3-amino-9-ethyl,9-ethylcarbazol-3-ylamine,unii-8q2bg27jbu,9-ethylcarbazole-3-ylamine,8q2bg27jbu,9-ethyl-9h-carbazol-3-ylamine
IUPAC Name	9-ethylcarbazol-3-amine
InChI Key	OXEUETBFKVCRNP-UHFFFAOYSA-N
Molecular Formula	C₁₄H₁₄N₂

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9-(4-Bromophenyl)carbazole, 98%, Thermo Scientific Chemicals

CAS: 57102-42-8 Molecular Formula: C18H12BrN Molecular Weight (g/mol): 322.205 MDL Number: MFCD11617969 InChI Key: XSDKKRKTDZMKCH-UHFFFAOYSA-N Synonym: 9-4-bromophenyl-9h-carbazole,9-4-bromophenyl carbazole,9-4-bromo-phenyl-9h-carbazole,9h-carbazole, 9-4-bromophenyl,acmc-209lw0,n-4-bromophenyl carbazole,amth018 PubChem CID: 22361390 IUPAC Name: 9-(4-bromophenyl)carbazole SMILES: C1=CC=C2C(=C1)C3=CC=CC=C3N2C4=CC=C(C=C4)Br

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Specifications

PubChem CID	22361390
CAS	57102-42-8
Molecular Weight (g/mol)	322.205
MDL Number	MFCD11617969
SMILES	C1=CC=C2C(=C1)C3=CC=CC=C3N2C4=CC=C(C=C4)Br
Synonym	9-4-bromophenyl-9h-carbazole,9-4-bromophenyl carbazole,9-4-bromo-phenyl-9h-carbazole,9h-carbazole, 9-4-bromophenyl,acmc-209lw0,n-4-bromophenyl carbazole,amth018
IUPAC Name	9-(4-bromophenyl)carbazole
InChI Key	XSDKKRKTDZMKCH-UHFFFAOYSA-N
Molecular Formula	C18H12BrN

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3-(1-Piperazinylmethyl)indole, 95%

CAS: 114746-66-6 Molecular Formula: C13H17N3 Molecular Weight (g/mol): 215.3 InChI Key: ZTNAIHGOFCMOPJ-UHFFFAOYSA-N Synonym: 3-piperazin-1-ylmethyl-1h-indole,1h-indole,3-1-piperazinylmethyl,acmc-1c6nr,1-1h-indole-3-ylmethyl piperazine,1h-indole, 3-1-piperazinylmethyl-, hydrochloride PubChem CID: 17880880 IUPAC Name: 3-(piperazin-1-ylmethyl)-1H-indole SMILES: C1CN(CCN1)CC2=CNC3=CC=CC=C32

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Specifications

PubChem CID	17880880
CAS	114746-66-6
Molecular Weight (g/mol)	215.3
SMILES	C1CN(CCN1)CC2=CNC3=CC=CC=C32
Synonym	3-piperazin-1-ylmethyl-1h-indole,1h-indole,3-1-piperazinylmethyl,acmc-1c6nr,1-1h-indole-3-ylmethyl piperazine,1h-indole, 3-1-piperazinylmethyl-, hydrochloride
IUPAC Name	3-(piperazin-1-ylmethyl)-1H-indole
InChI Key	ZTNAIHGOFCMOPJ-UHFFFAOYSA-N
Molecular Formula	C13H17N3

TraceCERT™ Base-Neut Surrogate Spike Mix, Certified Reference Material, MilliporeSigma™ Supelco™

This certified reference material (CRM) is produced and certified in accordance with ISO/IEC 17025 and ISO 17034. This CRM is traceable to the SI through a primary reference material from a NMI. Certified content incl. uncertainty and expiry date are stated on the enclosed certificate.

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2-Phenylindole, 95%

CAS: 948-65-2 Molecular Formula: C14H11N Molecular Weight (g/mol): 193.249 MDL Number: MFCD00005608 InChI Key: KLLLJCACIRKBDT-UHFFFAOYSA-N Synonym: 2-phenylindole,1h-indole, 2-phenyl,indole, 2-phenyl,stabilizer i,alpha-phenylindole,2-phenyl indole,phenylindole,unii-mqd44hv3p1,.alpha.-phenylindole,mqd44hv3p1 PubChem CID: 13698 IUPAC Name: 2-phenyl-1H-indole SMILES: C1=CC=C(C=C1)C2=CC3=CC=CC=C3N2

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Specifications

PubChem CID	13698
CAS	948-65-2
Molecular Weight (g/mol)	193.249
MDL Number	MFCD00005608
SMILES	C1=CC=C(C=C1)C2=CC3=CC=CC=C3N2
Synonym	2-phenylindole,1h-indole, 2-phenyl,indole, 2-phenyl,stabilizer i,alpha-phenylindole,2-phenyl indole,phenylindole,unii-mqd44hv3p1,.alpha.-phenylindole,mqd44hv3p1
IUPAC Name	2-phenyl-1H-indole
InChI Key	KLLLJCACIRKBDT-UHFFFAOYSA-N
Molecular Formula	C14H11N

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1-Boc-indole-2-boronic acid, 95%

CAS: 213318-44-6 Molecular Formula: C13H16BNO4 Molecular Weight (g/mol): 261.084 MDL Number: MFCD02093045 InChI Key: SVIBPSNFXYUOFT-UHFFFAOYSA-N Synonym: n-boc-indole-2-boronic acid,1-boc-indole-2-boronic acid,1-tert-butoxycarbonyl indole-2-boronic acid,1-tert-butoxycarbonyl-1h-indol-2-ylboronic acid,1-tert-butoxycarbonyl-1h-indol-2-yl boronic acid,1-n-boc-indole-2-boronic acid,1-tert-butoxycarbonyl-1h-indol-2-yl-2-boronic acid,1-tert-butoxycarbonyl indol-2-ylboronic acid,1-boc-2-indoleboronic acid,n-boc-indol-2-yl boronic acid PubChem CID: 2773302 IUPAC Name: [1-[(2-methylpropan-2-yl)oxycarbonyl]indol-2-yl]boronic acid SMILES: B(C1=CC2=CC=CC=C2N1C(=O)OC(C)(C)C)(O)O

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Specifications

PubChem CID	2773302
CAS	213318-44-6
Molecular Weight (g/mol)	261.084
MDL Number	MFCD02093045
SMILES	B(C1=CC2=CC=CC=C2N1C(=O)OC(C)(C)C)(O)O
Synonym	n-boc-indole-2-boronic acid,1-boc-indole-2-boronic acid,1-tert-butoxycarbonyl indole-2-boronic acid,1-tert-butoxycarbonyl-1h-indol-2-ylboronic acid,1-tert-butoxycarbonyl-1h-indol-2-yl boronic acid,1-n-boc-indole-2-boronic acid,1-tert-butoxycarbonyl-1h-indol-2-yl-2-boronic acid,1-tert-butoxycarbonyl indol-2-ylboronic acid,1-boc-2-indoleboronic acid,n-boc-indol-2-yl boronic acid
IUPAC Name	[1-[(2-methylpropan-2-yl)oxycarbonyl]indol-2-yl]boronic acid
InChI Key	SVIBPSNFXYUOFT-UHFFFAOYSA-N
Molecular Formula	C13H16BNO4

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5,6-Dihydroxyindole, 95%

CAS: 3131-52-0 Molecular Formula: C8H7NO2 Molecular Weight (g/mol): 149.149 MDL Number: MFCD00798933 InChI Key: SGNZYJXNUURYCH-UHFFFAOYSA-N Synonym: 5,6-dihydroxyindole,dopamine lutine,3h-indole-5,6-diol,5,6-dihydroxy-1h-indole,dhi,unii-z3oc8499kg,5,6-dihydroxyindolei,chembl92636,3id,5,6-dihydroxy indole PubChem CID: 114683 ChEBI: CHEBI:27404 IUPAC Name: 1H-indole-5,6-diol SMILES: C1=CNC2=CC(=C(C=C21)O)O

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Specifications

PubChem CID	114683
CAS	3131-52-0
Molecular Weight (g/mol)	149.149
ChEBI	CHEBI:27404
MDL Number	MFCD00798933
SMILES	C1=CNC2=CC(=C(C=C21)O)O
Synonym	5,6-dihydroxyindole,dopamine lutine,3h-indole-5,6-diol,5,6-dihydroxy-1h-indole,dhi,unii-z3oc8499kg,5,6-dihydroxyindolei,chembl92636,3id,5,6-dihydroxy indole
IUPAC Name	1H-indole-5,6-diol
InChI Key	SGNZYJXNUURYCH-UHFFFAOYSA-N
Molecular Formula	C8H7NO2

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Thermo Scientific Chemicals Rizatriptan benzoate

CAS: 145202-66-0 Molecular Formula: C22H25N5O2 Molecular Weight (g/mol): 391.48 InChI Key: JPRXYLQNJJVCMZ-UHFFFAOYSA-N IUPAC Name: benzoic acid; dimethyl(2-{5-[(1H-1,2,4-triazol-1-yl)methyl]-1H-indol-3-yl}ethyl)amine SMILES: OC(=O)C1=CC=CC=C1.CN(C)CCC1=CNC2=CC=C(CN3C=NC=N3)C=C12

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Specifications

CAS	145202-66-0
Molecular Weight (g/mol)	391.48
SMILES	OC(=O)C1=CC=CC=C1.CN(C)CCC1=CNC2=CC=C(CN3C=NC=N3)C=C12
IUPAC Name	benzoic acid; dimethyl(2-{5-[(1H-1,2,4-triazol-1-yl)methyl]-1H-indol-3-yl}ethyl)amine
InChI Key	JPRXYLQNJJVCMZ-UHFFFAOYSA-N
Molecular Formula	C22H25N5O2

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3-(9-Carbazolyl)benzeneboronic acid, 98%

CAS: 864377-33-3 Molecular Formula: C18H14BNO2 Molecular Weight (g/mol): 287.125 MDL Number: MFCD18072506 InChI Key: IDQUIFLAFFZYEX-UHFFFAOYSA-N Synonym: 3-9h-carbazol-9-yl phenylboronic acid,3-9h-carbazol-9-yl phenyl boronic acid,boronic acid, 3-9h-carbazol-9-yl phenyl,3-9-carbazolyl benzeneboronic acid,3-carbazol-9-yl phenylboronic acid,3-9h-9-carbozale phenylboronic acid,3-9h-9-carbazole phenylboronic acid,3-9h-carbazol-9-yl benzeneboronic acid PubChem CID: 56965778 IUPAC Name: (3-carbazol-9-ylphenyl)boronic acid SMILES: B(C1=CC(=CC=C1)N2C3=CC=CC=C3C4=CC=CC=C42)(O)O

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Specifications

PubChem CID	56965778
CAS	864377-33-3
Molecular Weight (g/mol)	287.125
MDL Number	MFCD18072506
SMILES	B(C1=CC(=CC=C1)N2C3=CC=CC=C3C4=CC=CC=C42)(O)O
Synonym	3-9h-carbazol-9-yl phenylboronic acid,3-9h-carbazol-9-yl phenyl boronic acid,boronic acid, 3-9h-carbazol-9-yl phenyl,3-9-carbazolyl benzeneboronic acid,3-carbazol-9-yl phenylboronic acid,3-9h-9-carbozale phenylboronic acid,3-9h-9-carbazole phenylboronic acid,3-9h-carbazol-9-yl benzeneboronic acid
IUPAC Name	(3-carbazol-9-ylphenyl)boronic acid
InChI Key	IDQUIFLAFFZYEX-UHFFFAOYSA-N
Molecular Formula	C18H14BNO2

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3-Indolebutyric acid, 98%

CAS: 133-32-4 Molecular Formula: C₁₂H₁₃NO₂ Molecular Weight (g/mol): 203.24 MDL Number: MFCD00005664 InChI Key: JTEDVYBZBROSJT-UHFFFAOYSA-N Synonym: indole-3-butyric acid,3-indolebutyric acid,4-1h-indol-3-yl butanoic acid,indolebutyric acid,hormodin,1h-indole-3-butanoic acid,seradix,indole-3-butanoic acid,jiffy grow,4-indol-3-yl butyric acid PubChem CID: 8617 ChEBI: CHEBI:33070 IUPAC Name: 4-(1H-indol-3-yl)butanoic acid SMILES: C1=CC=C2C(=C1)C(=CN2)CCCC(=O)O

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PubChem CID	8617
CAS	133-32-4
Molecular Weight (g/mol)	203.24
ChEBI	CHEBI:33070
MDL Number	MFCD00005664
SMILES	C1=CC=C2C(=C1)C(=CN2)CCCC(=O)O
Synonym	indole-3-butyric acid,3-indolebutyric acid,4-1h-indol-3-yl butanoic acid,indolebutyric acid,hormodin,1h-indole-3-butanoic acid,seradix,indole-3-butanoic acid,jiffy grow,4-indol-3-yl butyric acid
IUPAC Name	4-(1H-indol-3-yl)butanoic acid
InChI Key	JTEDVYBZBROSJT-UHFFFAOYSA-N
Molecular Formula	C₁₂H₁₃NO₂

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6-Hydroxyindole, 97%

CAS: 2380-86-1 Molecular Formula: C₈H₇NO Molecular Weight (g/mol): 133.15 InChI Key: XAWPKHNOFIWWNZ-UHFFFAOYSA-N Synonym: 6-hydroxyindole,6-indolol,indolol,6-hydroxy indole,unii-3i03jz599t,6-hydroxy-1h-indole,6hydroxyindole,6-hydroxy-indole,indol-6-ol,1h-indole-6-ol PubChem CID: 524508 IUPAC Name: 1H-indol-6-ol SMILES: C1=CC(=CC2=C1C=CN2)O

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PubChem CID	524508
CAS	2380-86-1
Molecular Weight (g/mol)	133.15
SMILES	C1=CC(=CC2=C1C=CN2)O
Synonym	6-hydroxyindole,6-indolol,indolol,6-hydroxy indole,unii-3i03jz599t,6-hydroxy-1h-indole,6hydroxyindole,6-hydroxy-indole,indol-6-ol,1h-indole-6-ol
IUPAC Name	1H-indol-6-ol
InChI Key	XAWPKHNOFIWWNZ-UHFFFAOYSA-N
Molecular Formula	C₈H₇NO

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9-Phenylcarbazole-3-boronic acid, 98%

CAS: 854952-58-2 Molecular Formula: C18H14BNO2 Molecular Weight (g/mol): 287.13 MDL Number: MFCD12196936 InChI Key: JWJQEUDGBZMPAX-UHFFFAOYSA-N Synonym: 9-phenyl-9h-carbazol-3-yl boronic acid,9-phenyl-9h-carbazol-3-ylboronic acid,9-phenyl carbazole-3-boronic acid,9-phenyl-3-carbazoleboronic acid,9-phenylcarbazole-3-boronic acid,b-9-phenyl-9h-carbazol-3-yl boronic acid,n-phenylcarbazole-3-boronic acid,3-borono-9-phenyl-9h-carbazole,pubchem23232,g00061-watson-int PubChem CID: 51358450 IUPAC Name: (9-phenylcarbazol-3-yl)boronic acid SMILES: OB(O)C1=CC2=C(C=C1)N(C1=C2C=CC=C1)C1=CC=CC=C1

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PubChem CID	51358450
CAS	854952-58-2
Molecular Weight (g/mol)	287.13
MDL Number	MFCD12196936
SMILES	OB(O)C1=CC2=C(C=C1)N(C1=C2C=CC=C1)C1=CC=CC=C1
Synonym	9-phenyl-9h-carbazol-3-yl boronic acid,9-phenyl-9h-carbazol-3-ylboronic acid,9-phenyl carbazole-3-boronic acid,9-phenyl-3-carbazoleboronic acid,9-phenylcarbazole-3-boronic acid,b-9-phenyl-9h-carbazol-3-yl boronic acid,n-phenylcarbazole-3-boronic acid,3-borono-9-phenyl-9h-carbazole,pubchem23232,g00061-watson-int
IUPAC Name	(9-phenylcarbazol-3-yl)boronic acid
InChI Key	JWJQEUDGBZMPAX-UHFFFAOYSA-N
Molecular Formula	C18H14BNO2

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2,3,3-Trimethylindolenine, 98%

CAS: 1640-39-7 Molecular Formula: C11H13N Molecular Weight (g/mol): 159.232 MDL Number: MFCD00005724 InChI Key: FLHJIAFUWHPJRT-UHFFFAOYSA-N Synonym: 2,3,3-trimethylindolenine,2,3,3-trimethyl-3h-indole,3h-indole, 2,3,3-trimethyl,ccris 6607,2,3,3-trimethyl-indolenin,2,3,3-trimethyl-3-hydroindole,pubchem7445,rarechem ah bs 0130,2,3-trimethylindolenine,2,3,3-trimethyl-indole PubChem CID: 15427 IUPAC Name: 2,3,3-trimethylindole SMILES: CC1=NC2=CC=CC=C2C1(C)C

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Specifications

PubChem CID	15427
CAS	1640-39-7
Molecular Weight (g/mol)	159.232
MDL Number	MFCD00005724
SMILES	CC1=NC2=CC=CC=C2C1(C)C
Synonym	2,3,3-trimethylindolenine,2,3,3-trimethyl-3h-indole,3h-indole, 2,3,3-trimethyl,ccris 6607,2,3,3-trimethyl-indolenin,2,3,3-trimethyl-3-hydroindole,pubchem7445,rarechem ah bs 0130,2,3-trimethylindolenine,2,3,3-trimethyl-indole
IUPAC Name	2,3,3-trimethylindole
InChI Key	FLHJIAFUWHPJRT-UHFFFAOYSA-N
Molecular Formula	C11H13N

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2-Amino-2-(5-indolyl)acetic acid, 98%

CAS: 108763-43-5 Molecular Formula: C10H10N2O2 Molecular Weight (g/mol): 190.202 MDL Number: MFCD06656882 InChI Key: XJJJDZBNTOYJAE-UHFFFAOYSA-N Synonym: 2-amino-2-1h-indol-5-yl acetic acid,amino 1h-indol-5-yl acetic acid,dl-alpha-amino-alpha-indol-5-yl acetic acid,1h-indole-5-acetic acid, a-amino,2-amino-2-5-indolyl acetic acid,1h-indole-5-acetic acid, alpha-amino PubChem CID: 54472597 IUPAC Name: 2-amino-2-(1H-indol-5-yl)acetic acid SMILES: C1=CC2=C(C=CN2)C=C1C(C(=O)O)N

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Specifications

PubChem CID	54472597
CAS	108763-43-5
Molecular Weight (g/mol)	190.202
MDL Number	MFCD06656882
SMILES	C1=CC2=C(C=CN2)C=C1C(C(=O)O)N
Synonym	2-amino-2-1h-indol-5-yl acetic acid,amino 1h-indol-5-yl acetic acid,dl-alpha-amino-alpha-indol-5-yl acetic acid,1h-indole-5-acetic acid, a-amino,2-amino-2-5-indolyl acetic acid,1h-indole-5-acetic acid, alpha-amino
IUPAC Name	2-amino-2-(1H-indol-5-yl)acetic acid
InChI Key	XJJJDZBNTOYJAE-UHFFFAOYSA-N
Molecular Formula	C10H10N2O2

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