NMR Solvents

Chloroform-d, for NMR, 99.8% atom D, ACROS Organics™

CAS: 865-49-6 Molecular Formula: CHCl3 Molecular Weight (g/mol): 120.375 MDL Number: MFCD00000827 InChI Key: HEDRZPFGACZZDS-MICDWDOJSA-N Synonym: 2h chloroform PubChem CID: 71583 ChEBI: CHEBI:85365 IUPAC Name: trichloro(deuterio)methane SMILES: C(Cl)(Cl)Cl

Deuterium oxide, for NMR, 99.8 atom % D, ACROS Organics™

CAS: 7789-20-0 Molecular Formula: H2O Molecular Weight (g/mol): 20.027 MDL Number: MFCD00044636 InChI Key: XLYOFNOQVPJJNP-ZSJDYOACSA-N Synonym: deuterated water PubChem CID: 24602 ChEBI: CHEBI:41981 SMILES: O

Methyl sulfoxide-d6, for NMR, packaged in 0.75mL ampoules, 99.9 atom % D, ACROS Organics™

CAS: 2206-27-1 Molecular Formula: C2H6OS Molecular Weight (g/mol): 84.166 MDL Number: MFCD00002090 InChI Key: IAZDPXIOMUYVGZ-WFGJKAKNSA-N Synonym: deuterated dmso PubChem CID: 75151 IUPAC Name: trideuterio(trideuteriomethylsulfinyl)methane SMILES: CS(=O)C

Deuterium chloride, for NMR, 1M solution in D2O, 99.8% atom D, AcroSeal™, ACROS Organics™

CAS: 7698-05-7 Molecular Formula: ClH Molecular Weight (g/mol): 36.46 MDL Number: MFCD00044642 InChI Key: VEXZGXHMUGYJMC-FTGQXOHASA-N Synonym: chloro 2h PubChem CID: 522634 SMILES: Cl

Ethanol - D6, deuteration degree min. 99% for NMR spectroscopy, MagniSolv™, EMD Miilipore™

CAS: 1516-08-1 Molecular Formula: C2H6O Molecular Weight (g/mol): 52.106 InChI Key: LFQSCWFLJHTTHZ-LIDOUZCJSA-N Synonym: 2 h? ethan 2 h ol PubChem CID: 102138 IUPAC Name: 1,1,1,2,2-pentadeuterio-2-deuteriooxyethane SMILES: CCO

Acetonitrile-d3, for NMR, 99.9% atom D, ACROS Organics™

CAS: 2206-26-0 Molecular Formula: C2H3N Molecular Weight (g/mol): 44.071 MDL Number: MFCD00001881 InChI Key: WEVYAHXRMPXWCK-FIBGUPNXSA-N Synonym: 2h3 acetonitrile PubChem CID: 123151 IUPAC Name: 2,2,2-trideuterioacetonitrile SMILES: CC#N

Deuterium oxide, for NMR, packaged in 0.75mL ampoules, 100.0% atom D, ACROS Organics™

CAS: 7789-20-0 Molecular Formula: H2O Molecular Weight (g/mol): 20.027 MDL Number: MFCD00044636 InChI Key: XLYOFNOQVPJJNP-ZSJDYOACSA-N Synonym: deuterated water PubChem CID: 24602 ChEBI: CHEBI:41981 SMILES: O

chloroform-d, for NMR, contains 0.03 v/v% TMS, +99.8 atom % D, AcroSeal™, ACROS Organics™

CAS: 865-49-6 Molecular Formula: CHCl3 Molecular Weight (g/mol): 120.375 MDL Number: MFCD00000827 InChI Key: HEDRZPFGACZZDS-MICDWDOJSA-N Synonym: 2h chloroform PubChem CID: 71583 ChEBI: CHEBI:85365 IUPAC Name: trichloro(deuterio)methane SMILES: C(Cl)(Cl)Cl

Chloroform-d, for NMR, 99.8% atom D, ACROS Organics™, packaged in 0.75mL ampoules, ACROS Organics™

CAS: 865-49-6 Molecular Formula: CHCl3 Molecular Weight (g/mol): 120.375 MDL Number: MFCD00000827 InChI Key: HEDRZPFGACZZDS-MICDWDOJSA-N Synonym: 2h chloroform PubChem CID: 71583 ChEBI: CHEBI:85365 IUPAC Name: trichloro(deuterio)methane SMILES: C(Cl)(Cl)Cl

Methanol-d4, Packaged in 0.75mL Ampules 99.8 atom% D, ACROS Organics™

CAS: 811-98-3 Molecular Formula: CH4O Molecular Weight (g/mol): 36.066 MDL Number: MFCD00044637 InChI Key: OKKJLVBELUTLKV-MZCSYVLQSA-N Synonym: 2h4 methanol PubChem CID: 71568 IUPAC Name: trideuterio(deuteriooxy)methane SMILES: CO

Dimethyl sulfoxide - D6, deuteration degree min. 99.8% for NMR spectroscopy, MagniSolv™, MilliporeSigma™

CAS: 2206-27-1 Molecular Formula: C2H6OS Molecular Weight (g/mol): 84.166 InChI Key: IAZDPXIOMUYVGZ-WFGJKAKNSA-N Synonym: deuterated dmso PubChem CID: 75151 IUPAC Name: trideuterio(trideuteriomethylsulfinyl)methane SMILES: CS(=O)C

Sodium deuteroxide, for NMR, 40 wt.% solution in D2O, 99+% atom D, ACROS Organics™

CAS: 14014-06-3 Molecular Formula: HNaO Molecular Weight (g/mol): 41.003 MDL Number: MFCD00037669 InChI Key: HEMHJVSKTPXQMS-DYCDLGHISA-M Synonym: naod PubChem CID: 23676750 SMILES: [OH-].[Na+]

Deuterium oxide, deuteration degree min. 99.9% for NMR spectroscopy MagniSolv™, MilliporeSigma™

CAS: 7789-20-0 Molecular Formula: H2O Molecular Weight (g/mol): 20.027 InChI Key: XLYOFNOQVPJJNP-ZSJDYOACSA-N Synonym: deuterated water PubChem CID: 24602 ChEBI: CHEBI:41981 SMILES: O

Acetone - D6, deuteration degree min. 99.9% for NMR spectroscopy MagniSolv™, MilliporeSigma™

CAS: 666-52-4 Molecular Formula: C3H6O Molecular Weight (g/mol): 64.117 InChI Key: CSCPPACGZOOCGX-WFGJKAKNSA-N Synonym: 2-propanone-1,1,1,3,3,3-d6 PubChem CID: 522220 ChEBI: CHEBI:78217 IUPAC Name: 1,1,1,3,3,3-hexadeuteriopropan-2-one SMILES: CC(=O)C

Acetonitrile-d3, for NMR, packaged in 0.75 ml ampoules, 99.8 atom % D, ACROS Organics™

CAS: 2206-26-0 Molecular Formula: C2H3N Molecular Weight (g/mol): 44.071 MDL Number: MFCD00001881 InChI Key: WEVYAHXRMPXWCK-FIBGUPNXSA-N Synonym: 2h3 acetonitrile PubChem CID: 123151 IUPAC Name: 2,2,2-trideuterioacetonitrile SMILES: CC#N

Dimethyl sulfoxide-d6, 99.9% (Isotopic), Alfa Aesar™

CAS: 2206-27-1 Molecular Formula: C2H6OS Molecular Weight (g/mol): 84.166 MDL Number: MFCD00002090 InChI Key: IAZDPXIOMUYVGZ-WFGJKAKNSA-N Synonym: deuterated dmso PubChem CID: 75151 IUPAC Name: trideuterio(trideuteriomethylsulfinyl)methane SMILES: CS(=O)C

Deuterium oxide, for NMR, packaged in 0.75mL ampoules, 99.8% atom D, ACROS Organics™

CAS: 7789-20-0 Molecular Formula: H2O Molecular Weight (g/mol): 20.027 MDL Number: MFCD00044636 InChI Key: XLYOFNOQVPJJNP-ZSJDYOACSA-N Synonym: deuterated water PubChem CID: 24602 ChEBI: CHEBI:41981 SMILES: O

Methyl sulfoxide-d6, for NMR, 99.9% atom D, ACROS Organics™

CAS: 2206-27-1 Molecular Formula: C2H6OS Molecular Weight (g/mol): 84.166 MDL Number: MFCD00002090 InChI Key: IAZDPXIOMUYVGZ-WFGJKAKNSA-N Synonym: deuterated dmso PubChem CID: 75151 IUPAC Name: trideuterio(trideuteriomethylsulfinyl)methane SMILES: CS(=O)C

Acetone-d6, for NMR, packaged in 0.75mL ampoules, 99.9% atom D, ACROS Organics™

CAS: 666-52-4 Molecular Formula: C3H6O Molecular Weight (g/mol): 64.117 MDL Number: MFCD00044635 InChI Key: CSCPPACGZOOCGX-WFGJKAKNSA-N Synonym: 2-propanone-1,1,1,3,3,3-d6 PubChem CID: 522220 ChEBI: CHEBI:78217 IUPAC Name: 1,1,1,3,3,3-hexadeuteriopropan-2-one SMILES: CC(=O)C

Methanol-d, for NMR, 99.0 atom % D, ACROS Organics™

CAS: 1455-13-6 Molecular Formula: CH4O Molecular Weight (g/mol): 33.048 MDL Number: MFCD00044213 InChI Key: OKKJLVBELUTLKV-VMNATFBRSA-N Synonym: ch3od PubChem CID: 123113 IUPAC Name: deuteriooxymethane SMILES: CO

Deuterium chloride, for NMR, 20 wt.% solution in D2O, 100.0% atom D, ACROS Organics™

CAS: 7698-05-7 Molecular Formula: ClH Molecular Weight (g/mol): 36.46 MDL Number: MFCD00044642 InChI Key: VEXZGXHMUGYJMC-FTGQXOHASA-N Synonym: chloro 2h PubChem CID: 522634 SMILES: Cl

Sulfuric acid-d2, for NMR, 98 wt.% in D2O, 99.5+% atom D, ACROS Organics™

CAS: 13813-19-9 Molecular Formula: H2O4S Molecular Weight (g/mol): 100.084 MDL Number: MFCD00003542 InChI Key: QAOWNCQODCNURD-ZSJDYOACSA-N Synonym: 2 h? sulfuric acid PubChem CID: 160992 IUPAC Name: dideuterio sulfate SMILES: OS(=O)(=O)O

Toluene-d8, for NMR, +99% atom D, ACROS Organics™

CAS: 2037-26-5 Molecular Formula: C7H8 Molecular Weight (g/mol): 100.19 MDL Number: MFCD00044638 InChI Key: YXFVVABEGXRONW-JGUCLWPXSA-N Synonym: 1,2,3,4,5-pentadeuterio-6-trideuteriomethyl benzene PubChem CID: 74861 IUPAC Name: 1,2,3,4,5-pentadeuterio-6-(trideuteriomethyl)benzene SMILES: CC1=CC=CC=C1

Dimethyl sulfoxide-d6, 99.5% (Isotopic), Alfa Aesar™

CAS: 2206-27-1 Molecular Formula: C2H6OS Molecular Weight (g/mol): 84.166 MDL Number: MFCD00002090 InChI Key: IAZDPXIOMUYVGZ-WFGJKAKNSA-N Synonym: deuterated dmso PubChem CID: 75151 IUPAC Name: trideuterio(trideuteriomethylsulfinyl)methane SMILES: CS(=O)C

Deuterium oxide, deuteration degree min. 99.96% for NMR spectroscopy, MagniSolv™, MilliporeSigma™

CAS: 7789-20-0 Molecular Formula: H2O Molecular Weight (g/mol): 20.027 InChI Key: XLYOFNOQVPJJNP-ZSJDYOACSA-N Synonym: deuterated water PubChem CID: 24602 ChEBI: CHEBI:41981 SMILES: O

Alfa Aesar™ 1,4-Dioxane-d8, 99% (Isotopic)

CAS: 17647-74-4 Molecular Formula: C4H8O2 Molecular Weight (g/mol): 96.155 MDL Number: MFCD00044239 InChI Key: RYHBNJHYFVUHQT-SVYQBANQSA-N Synonym: 1 4-dioxane-d8 99 atom % d PubChem CID: 87209 IUPAC Name: 2,2,3,3,5,5,6,6-octadeuterio-1,4-dioxane SMILES: C1COCCO1

Methanol-d4, for NMR, 99.8% atom D, ACROS Organics™

CAS: 811-98-3 Molecular Formula: CH4O Molecular Weight (g/mol): 36.066 MDL Number: MFCD00044637 InChI Key: OKKJLVBELUTLKV-MZCSYVLQSA-N Synonym: 2h4 methanol PubChem CID: 71568 IUPAC Name: trideuterio(deuteriooxy)methane SMILES: CO

Acetone-d6, for NMR, 99.5 atom % D, ACROS Organics™

CAS: 666-52-4 Molecular Formula: C3H6O Molecular Weight (g/mol): 64.117 MDL Number: MFCD00044635 InChI Key: CSCPPACGZOOCGX-WFGJKAKNSA-N Synonym: 2-propanone-1,1,1,3,3,3-d6 PubChem CID: 522220 ChEBI: CHEBI:78217 IUPAC Name: 1,1,1,3,3,3-hexadeuteriopropan-2-one SMILES: CC(=O)C

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