Isotopically Labeled Compounds

Formic acid-d2, for NMR, +99% atom D, 95% solution in D2O, Thermo Scientific™

Formic acid-d2, for NMR, +99% atom D, 95% solution in D2O, Thermo Scientific™

CAS: 920-42-3 Molecular Formula: CH2O2 Molecular Weight (g/mol): 48.037 MDL Number: MFCD00037363 InChI Key: BDAGIHXWWSANSR-PFUFQJKNSA-N Synonym: formic acid-d2, 2h formic 2 acid, dcood, 2h2 formic acid, formic-d acid-d 6ci,7ci,8ci,9ci, formic-d acid-d, 95 wt% in deuterium oxide, formic acid-d2, 95 wt. % in d2o, 98 atom % d PubChem CID: 123092 IUPAC Name: deuterio deuterioformate SMILES: C(=O)O

Pyridine-d{5}, 99.5% (Isotopic), contains 0.05% v/v TMS, Thermo Scientific™

Pyridine-d{5}, 99.5% (Isotopic), contains 0.05% v/v TMS, Thermo Scientific™

CAS: 7291-22-7 Molecular Formula: C5H5N Molecular Weight (g/mol): 84.13 MDL Number: MFCD00044639 InChI Key: JUJWROOIHBZHMG-RALIUCGRSA-N Synonym: pyridine-d5, 2h5 pyridine, c5d5n, 2 h? pyridine, pyridine d5, pyridine,crude,light, pyridine, perdeutero, ∼2∼h_5_ pyridine, de85c PubChem CID: 558519 IUPAC Name: 2,3,4,5,6-pentadeuteriopyridine SMILES: [2H]C1=NC([2H])=C([2H])C([2H])=C1[2H]

Dimethyl sulfoxide-d{6}, 100% (Isotopic), contains 0.03% v/v TMS, Thermo Scientific™

Dimethyl sulfoxide-d{6}, 100% (Isotopic), contains 0.03% v/v TMS, Thermo Scientific™

CAS: 2206-27-1 Molecular Formula: C2H6OS Molecular Weight (g/mol): 84.17 MDL Number: MFCD00002090 InChI Key: IAZDPXIOMUYVGZ-WFGJKAKNSA-N Synonym: dimethyl sulfoxide-d6, dmso-d6, dimethylsulfoxide-d6, deuterated dmso, methane-d3,sulfinylbis-9ci, methane-d3, sulfinylbis, hexadeuterodimethyl sulfoxide, methane-d3-, sulfinylbis, methanesulfinylmethyl hydrogen, dimethyl-d6 sulfoxide PubChem CID: 75151 IUPAC Name: trideuterio(trideuteriomethylsulfinyl)methane SMILES: [2H]C([2H])([2H])S(=O)C([2H])([2H])[2H]

Ethanol-d6, for NMR, anhydrous, 99% atom D, Thermo Scientific™

Ethanol-d6, for NMR, anhydrous, 99% atom D, Thermo Scientific™

CAS: 1516-08-1 Molecular Formula: C2H6O Molecular Weight (g/mol): 52.106 MDL Number: MFCD00051020 InChI Key: LFQSCWFLJHTTHZ-LIDOUZCJSA-N Synonym: ethanol-d6, 2h6 ethanol, hexadeuteroethanol, 2 h? ethan 2 h ol, ethyl-d5 alcohol-d, ethyl alcohol-d6, ethanol d, ethanol-d6 9ci PubChem CID: 102138 IUPAC Name: 1,1,1,2,2-pentadeuterio-2-deuteriooxyethane SMILES: CCO

2-Propanol-d{8}, 99%(Isotopic), Thermo Scientific™

2-Propanol-d{8}, 99%(Isotopic), Thermo Scientific™

CAS: 22739-76-0 Molecular Formula: C3H8O Molecular Weight (g/mol): 68.15 MDL Number: MFCD00044341 InChI Key: KFZMGEQAYNKOFK-PIODKIDGSA-N Synonym: 2-propanol-d8, isopropanol-d8, 2 h? propan-2-2 h ol, octadeuteroisopropanol, 2h8-2-propanol, 2-propan-1,1,1,2,3,3,3-d7-ol-d, 2-propanol-d isotopic 1g, 2-propanol-d8, 99.5 atom % d PubChem CID: 2723972 IUPAC Name: (²H₇)propan-2-(²H)ol SMILES: [2H]OC([2H])(C([2H])([2H])[2H])C([2H])([2H])[2H]

Pyridine-d5, for NMR, 99% atom D, Thermo Scientific™

Pyridine-d5, for NMR, 99% atom D, Thermo Scientific™

CAS: 7291-22-7 Molecular Formula: C5H5N Molecular Weight (g/mol): 84.13 MDL Number: MFCD00044639 InChI Key: JUJWROOIHBZHMG-RALIUCGRSA-N Synonym: pyridine-d5, 2h5 pyridine, c5d5n, 2 h? pyridine, pyridine d5, pyridine,crude,light, pyridine, perdeutero, ∼2∼h_5_ pyridine, de85c PubChem CID: 558519 IUPAC Name: 2,3,4,5,6-pentadeuteriopyridine SMILES: [2H]C1=NC([2H])=C([2H])C([2H])=C1[2H]

Acetic-d3 acid-d, for NMR, 99.5% atom D, Thermo Scientific™

Acetic-d3 acid-d, for NMR, 99.5% atom D, Thermo Scientific™

CAS: 1186-52-3 Molecular Formula: C2H4O2 Molecular Weight (g/mol): 64.08 MDL Number: MFCD00051051 InChI Key: QTBSBXVTEAMEQO-GUEYOVJQSA-N Synonym: acetic acid-d4, acetic-d3 acid-d, 2h3 acetic 2h acid, tetradeuteroacetic acid, 2 h? ethan 2 h oic acid, acetic acid d4, 2h4 acetic acid, cd3cood, acetic acid d, acetic acid-d4, 99.5 atom % d PubChem CID: 2723903 IUPAC Name: deuterio 2,2,2-trideuterioacetate SMILES: [2H]OC(=O)C([2H])([2H])[2H]

Chloroform-d, for NMR, 99.8% atom D, stabilized with silver foil, Thermo Scientific™

Chloroform-d, for NMR, 99.8% atom D, stabilized with silver foil, Thermo Scientific™

CAS: 865-49-6 Molecular Formula: CHCl3 Molecular Weight (g/mol): 120.375 MDL Number: MFCD00000827 InChI Key: HEDRZPFGACZZDS-MICDWDOJSA-N Synonym: chloroform-d, deuterochloroform, methane-d, trichloro, 2h chloroform, deuterated chloroform, cdcl3, trichloromethane-d, unii-p1nw4885vt, trichloro deuterio methane, chloroform, deutero PubChem CID: 71583 ChEBI: CHEBI:85365 IUPAC Name: trichloro(deuterio)methane SMILES: C(Cl)(Cl)Cl

Tetrahydrofuran-D8, for NMR, 99.5 atom % D, Thermo Scientific™

Tetrahydrofuran-D8, for NMR, 99.5 atom % D, Thermo Scientific™

CAS: 1693-74-9 Molecular Formula: C4H8O Molecular Weight (g/mol): 80.16 MDL Number: MFCD00044238 InChI Key: WYURNTSHIVDZCO-SVYQBANQSA-N Synonym: tetrahydrofuran-d8, deuterated thf, octadeuterotetrahydrofuran, deuterated tetrahydrofuran, tetrahydrofuran-d8 thf-d8, tetrahydrofuran-d8, >=99.5 atom % d, 2h4 tetrahydro 2h4 furan, thf-d8, 2h8 tetrahydrofuran, furan-d4-, tetrahydro-d4 PubChem CID: 80290 IUPAC Name: 2,2,3,3,4,4,5,5-octadeuteriooxolane SMILES: [2H]C1([2H])OC([2H])([2H])C([2H])([2H])C1([2H])[2H]

Methyl sulfoxide-d6, for NMR, contains 0.03% TMS, 99.8 atom% D, Thermo Scientific™

Methyl sulfoxide-d6, for NMR, contains 0.03% TMS, 99.8 atom% D, Thermo Scientific™

CAS: 2206-27-1 Molecular Formula: C2H6OS Molecular Weight (g/mol): 84.17 MDL Number: MFCD00002090 InChI Key: IAZDPXIOMUYVGZ-WFGJKAKNSA-N Synonym: dimethyl sulfoxide-d6, dmso-d6, dimethylsulfoxide-d6, deuterated dmso, methane-d3,sulfinylbis-9ci, methane-d3, sulfinylbis, hexadeuterodimethyl sulfoxide, methane-d3-, sulfinylbis, methanesulfinylmethyl hydrogen, dimethyl-d6 sulfoxide PubChem CID: 75151 IUPAC Name: trideuterio(trideuteriomethylsulfinyl)methane SMILES: [2H]C([2H])([2H])S(=O)C([2H])([2H])[2H]

1,1,2,2-Tetrachloroethane-d2, for NMR, 99.5+ atom% D, Thermo Scientific™

1,1,2,2-Tetrachloroethane-d2, for NMR, 99.5+ atom% D, Thermo Scientific™

CAS: 33685-54-0 Molecular Formula: C2H2Cl4 Molecular Weight (g/mol): 169.85 MDL Number: MFCD00037672 InChI Key: QPFMBZIOSGYJDE-QDNHWIQGSA-N Synonym: 1,1,2,2-tetrachloroethane-d2, 1,2-dideutero-1,1,2,2-tetrachloroethane, tetrachloro 2 h? ethane, 1,1,2,2-tetrachloroethane-d2 tce-d2, ethane-d2, 1,1,2,2-tetrachloro, ethane-1,2-d2, 1,1,2,2-tetrachloro, 1,1,2,2-tetrachloro-1,2-2h2 ethane, de87d, 1,1,2,2-tetrachloroethane-d2 >99.50 atom % d, 1,1,2,2-tetrachloroethane-d2, >=99.5 atom % d PubChem CID: 118531 IUPAC Name: 1,1,2,2-tetrachloro-1,2-dideuterioethane SMILES: C(C(Cl)Cl)(Cl)Cl

Methanol-d4, for NMR, 99.8% atom D, Thermo Scientific™

Methanol-d4, for NMR, 99.8% atom D, Thermo Scientific™

CAS: 811-98-3 Molecular Formula: CH4O Molecular Weight (g/mol): 36.066 MDL Number: MFCD00044637 InChI Key: OKKJLVBELUTLKV-MZCSYVLQSA-N Synonym: methanol-d4, perdeuteromethanol, tetradeuteromethanol, methan-d3-ol-d, 2h4 methanol, methyl alcohol-d4, cd3od, methyl-d3 alcohol-d, trideuterio deuteriooxy methane, methanol-d4, 99.8 atom % d PubChem CID: 71568 IUPAC Name: trideuterio(deuteriooxy)methane SMILES: CO

Methyl sulfoxide-d6, for NMR, with 0.03% TMS, 99.9 atom% D, Thermo Scientific™

Methyl sulfoxide-d6, for NMR, with 0.03% TMS, 99.9 atom% D, Thermo Scientific™

CAS: 2206-27-1 Molecular Formula: C2H6OS Molecular Weight (g/mol): 84.17 MDL Number: MFCD00002090 InChI Key: IAZDPXIOMUYVGZ-WFGJKAKNSA-N Synonym: dimethyl sulfoxide-d6, dmso-d6, dimethylsulfoxide-d6, deuterated dmso, methane-d3,sulfinylbis-9ci, methane-d3, sulfinylbis, hexadeuterodimethyl sulfoxide, methane-d3-, sulfinylbis, methanesulfinylmethyl hydrogen, dimethyl-d6 sulfoxide PubChem CID: 75151 IUPAC Name: trideuterio(trideuteriomethylsulfinyl)methane SMILES: [2H]C([2H])([2H])S(=O)C([2H])([2H])[2H]

Pyridine-d5, for NMR, with 0.03% TMS, 100.0 atom% D, Thermo Scientific™

Pyridine-d5, for NMR, with 0.03% TMS, 100.0 atom% D, Thermo Scientific™

CAS: 7291-22-7 Molecular Formula: C5H5N Molecular Weight (g/mol): 84.13 MDL Number: MFCD00044639 InChI Key: JUJWROOIHBZHMG-RALIUCGRSA-N Synonym: pyridine-d5, 2h5 pyridine, c5d5n, 2 h? pyridine, pyridine d5, pyridine,crude,light, pyridine, perdeutero, ∼2∼h_5_ pyridine, de85c PubChem CID: 558519 IUPAC Name: 2,3,4,5,6-pentadeuteriopyridine SMILES: [2H]C1=NC([2H])=C([2H])C([2H])=C1[2H]

Chloroform-d, for NMR, 99.8+% atom D, contains 0.03 v/v% TMS, Thermo Scientific™

Chloroform-d, for NMR, 99.8+% atom D, contains 0.03 v/v% TMS, Thermo Scientific™

CAS: 865-49-6 Molecular Formula: CHCl3 Molecular Weight (g/mol): 120.375 MDL Number: MFCD00000827 InChI Key: HEDRZPFGACZZDS-MICDWDOJSA-N Synonym: chloroform-d, deuterochloroform, methane-d, trichloro, 2h chloroform, deuterated chloroform, cdcl3, trichloromethane-d, unii-p1nw4885vt, trichloro deuterio methane, chloroform, deutero PubChem CID: 71583 ChEBI: CHEBI:85365 IUPAC Name: trichloro(deuterio)methane SMILES: C(Cl)(Cl)Cl

Acetone-d6, for NMR, contains 1 v/v% TMS, 99.5% atom D, Thermo Scientific™

Acetone-d6, for NMR, contains 1 v/v% TMS, 99.5% atom D, Thermo Scientific™

CAS: 666-52-4 Molecular Formula: C3H6O Molecular Weight (g/mol): 64.117 MDL Number: MFCD00044635 InChI Key: CSCPPACGZOOCGX-WFGJKAKNSA-N Synonym: acetone-d6, 2h6 acetone, hexadeuteroacetone, acetone d6, perdeuteroacetone, deuterated acetone, unii-b0n19b53h8, cd3 2co, 2-propanone-1,1,1,3,3,3-d6, d6-acetone PubChem CID: 522220 ChEBI: CHEBI:78217 IUPAC Name: 1,1,1,3,3,3-hexadeuteriopropan-2-one SMILES: CC(=O)C

Chloroform-d, for NMR, 99.8% atom D, contains 1 v/v% TMS, Thermo Scientific™

Chloroform-d, for NMR, 99.8% atom D, contains 1 v/v% TMS, Thermo Scientific™

CAS: 865-49-6 Molecular Formula: CHCl3 Molecular Weight (g/mol): 120.375 MDL Number: MFCD00000827 InChI Key: HEDRZPFGACZZDS-MICDWDOJSA-N Synonym: chloroform-d, deuterochloroform, methane-d, trichloro, 2h chloroform, deuterated chloroform, cdcl3, trichloromethane-d, unii-p1nw4885vt, trichloro deuterio methane, chloroform, deutero PubChem CID: 71583 ChEBI: CHEBI:85365 IUPAC Name: trichloro(deuterio)methane SMILES: C(Cl)(Cl)Cl

Acetonitrile-d3, for NMR, 99.8 atom % D, Thermo Scientific™

Acetonitrile-d3, for NMR, 99.8 atom % D, Thermo Scientific™

CAS: 2206-26-0 Molecular Formula: C2D3N Molecular Weight (g/mol): 44.07

Styrene-d8, for NMR, 98+% atom D, stabilized, Thermo Scientific™

Styrene-d8, for NMR, 98+% atom D, stabilized, Thermo Scientific™

CAS: 19361-62-7 Molecular Formula: C8H8 Molecular Weight (g/mol): 112.201 MDL Number: MFCD00044231 InChI Key: PPBRXRYQALVLMV-GDALLCCDSA-N Synonym: styrene-d8, 2h8 styrene, perdeuteriostyrene, benzene-d5, ethenyl-d3, 1,2,3,4,5-pentadeuterio-6-1,2,2-trideuterioethenyl benzene, benzene-1,2,3,4,5-d5, 6-ethenyl-1,2,2-d3, styrene d8, phenethylene-d8, phenylethene-d8, vinylbenzene-d8 PubChem CID: 88025 IUPAC Name: 1,2,3,4,5-pentadeuterio-6-(1,2,2-trideuterioethenyl)benzene SMILES: C=CC1=CC=CC=C1

Sodium borodeuteride, 99% (Isotopic), Thermo Scientific™

Sodium borodeuteride, 99% (Isotopic), Thermo Scientific™

CAS: 15681-89-7 Molecular Formula: BH4Na Molecular Weight (g/mol): 37.83 MDL Number: MFCD00003519 InChI Key: YOQDYZUWIQVZSF-UHFFFAOYSA-N Synonym: sodium borodeuteride, sodium tetradeuterioboron, sodium borohydride-d4, sodium 2h4 tetrahydroborate 1-, sulfatase, borate 1-, tetrahydro-d4-, sodium, nabd4, sodium 2h4 boranuide, deuterated sodium borohydride PubChem CID: 23673181 IUPAC Name: sodium boranuide SMILES: [BH4-].[Na+]

Pyridine-d5, for NMR, 100.0% atom D, Thermo Scientific™

Pyridine-d5, for NMR, 100.0% atom D, Thermo Scientific™

CAS: 7291-22-7 Molecular Formula: C5H5N Molecular Weight (g/mol): 84.13 MDL Number: MFCD00044639 InChI Key: JUJWROOIHBZHMG-RALIUCGRSA-N Synonym: pyridine-d5, 2h5 pyridine, c5d5n, 2 h? pyridine, pyridine d5, pyridine,crude,light, pyridine, perdeutero, ∼2∼h_5_ pyridine, de85c PubChem CID: 558519 IUPAC Name: 2,3,4,5,6-pentadeuteriopyridine SMILES: [2H]C1=NC([2H])=C([2H])C([2H])=C1[2H]

Toluene-d8, for NMR, 99.5+% atom D, Thermo Scientific™

Toluene-d8, for NMR, 99.5+% atom D, Thermo Scientific™

CAS: 2037-26-5 Molecular Formula: C7H8 Molecular Weight (g/mol): 100.19 MDL Number: MFCD00044638 InChI Key: YXFVVABEGXRONW-JGUCLWPXSA-N Synonym: toluene-d8, 2h8 toluene, perdeuteriotoluene, benzene-d5, methyl-d3, perdeuterotoluene, benzene-d5-, methyl-d3, 1,2,3,4,5-pentadeuterio-6-trideuteriomethyl benzene, toluene d8, toluene-d8, 99 atom % d, toluene-d8, 99.6 atom % d PubChem CID: 74861 IUPAC Name: 1,2,3,4,5-pentadeuterio-6-(trideuteriomethyl)benzene SMILES: CC1=CC=CC=C1

Acetonitrile-d3, for NMR, 99% atom D, Thermo Scientific™

Acetonitrile-d3, for NMR, 99% atom D, Thermo Scientific™

CAS: 2206-26-0 Molecular Formula: C2H3N Molecular Weight (g/mol): 44.07 MDL Number: MFCD00001881 InChI Key: WEVYAHXRMPXWCK-FIBGUPNXSA-N Synonym: acetonitrile-d3, 2h3 acetonitrile, cd3cn, acetonitrile-2,2,2-d3, methyl-d3 cyanide, trideuteroacetonitrile, acetonitrile-d3, 99.8 atom % d, acetonitrile-d3, >=99.8 atom % d, acetonitrile-d isotopic 5g PubChem CID: 123151 IUPAC Name: 2,2,2-trideuterioacetonitrile SMILES: [2H]C([2H])([2H])C#N

Acetic acid, ammonium salt-d<sub>7</sub>, 99 atom % D, Thermo Scientific™

Acetic acid, ammonium salt-d7, 99 atom % D, Thermo Scientific™

CAS: 194787-05-8 Molecular Formula: C2H7NO2 Molecular Weight (g/mol): 84.126 InChI Key: USFZMSVCRYTOJT-KYWLLVRESA-N Synonym: ammonium acetate-d7, 98 atom % d, acetic-d3 acid-d,ammonium-d4 salt 9ci, 2 h? amine; 2 h? ethan 2 h oic acid, ∼2∼h_4_ acetic acid-∼2∼h_3_ ammonia 1/1 PubChem CID: 51341917 SMILES: CC(=O)O.N

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