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Isotopisk mærkede forbindelser

Kemikalier, hvortil der er knyttet isotoper for at mærke specifikke atomer. Isotopmærkede forbindelser er almindeligt anvendt i syntetisk kemi, karakteriseringsteknikker såsom NMR og biologi.

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1

Methylsulfoxid-d6, til NMR, 99,5+% atom D, Thermo Scientific Chemicals

CAS: 2206-27-1 Molekylær formel: C2H6OS Molekylvægt (g/mol): 84.17 MDL nummer: MFCD00002090 InChI nøgle: 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 SMIL: [2H]C([2H])([2H])S(=O)C([2H])([2H])[2H]

MDL nummer MFCD00002090
PubChem CID 75151
Molekylvægt (g/mol) 84.17
CAS 2206-27-1
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
SMIL [2H]C([2H])([2H])S(=O)C([2H])([2H])[2H]
InChI nøgle IAZDPXIOMUYVGZ-WFGJKAKNSA-N
Molekylær formel C2H6OS
2

Deuteriumoxid, til NMR, 99,8 atom % D, Thermo Scientific Chemicals

CAS: 7789-20-0 Molekylær formel: H2O Molekylvægt (g/mol): 20.03 MDL nummer: MFCD00044636 InChI nøgle: XLYOFNOQVPJJNP-ZSJDYOACSA-N Synonym: heavy water-d2,heavy water d2o,heavy water,water, heavy d2-o,dideuterium oxide,deuterium oxide,water sup 2-h2,deuterium oxide usan,deuterated water,water-d2 PubChem CID: 24602 ChEBI: CHEBI:41981 IUPAC navn: [(²H)oxy](²H) SMIL: [2H]O[2H]

MDL nummer MFCD00044636
PubChem CID 24602
Molekylvægt (g/mol) 20.03
CAS 7789-20-0
ChEBI CHEBI:41981
Synonym heavy water-d2,heavy water d2o,heavy water,water, heavy d2-o,dideuterium oxide,deuterium oxide,water sup 2-h2,deuterium oxide usan,deuterated water,water-d2
SMIL [2H]O[2H]
IUPAC navn [(²H)oxy](²H)
InChI nøgle XLYOFNOQVPJJNP-ZSJDYOACSA-N
Molekylær formel H2O
3
Kampagner er tilgængelige

Methyl sulfoxide-d6, for NMR, 99.8 atom % D

CAS: 2206-27-1 Molekylær formel: C2H6OS Molekylvægt (g/mol): 84.17 MDL nummer: MFCD00002090 InChI nøgle: 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 SMIL: [2H]C([2H])([2H])S(=O)C([2H])([2H])[2H]

MDL nummer MFCD00002090
PubChem CID 75151
Molekylvægt (g/mol) 84.17
CAS 2206-27-1
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
SMIL [2H]C([2H])([2H])S(=O)C([2H])([2H])[2H]
InChI nøgle IAZDPXIOMUYVGZ-WFGJKAKNSA-N
Molekylær formel C2H6OS
4

Chloroform-d, for NMR, 99,8 % atom D, Thermo Scientific Chemicals

CAS: 865-49-6 Molekylær formel: CHCl3 Molekylvægt (g/mol): 120.375 MDL nummer: MFCD00000827 InChI nøgle: 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 navn: trichlor(deuterio)methan SMIL: C(Cl)(Cl)Cl

MDL nummer MFCD00000827
PubChem CID 71583
Molekylvægt (g/mol) 120.375
CAS 865-49-6
ChEBI CHEBI:85365
Synonym chloroform-d,deuterochloroform,methane-d, trichloro,2h chloroform,deuterated chloroform,cdcl3,trichloromethane-d,unii-p1nw4885vt,trichloro deuterio methane,chloroform, deutero
SMIL C(Cl)(Cl)Cl
IUPAC navn trichlor(deuterio)methan
InChI nøgle HEDRZPFGACZZDS-MICDWDOJSA-N
Molekylær formel CHCl3
5

Methylsulfoxid-d6, for NMR, +99 % atom D, Thermo Scientific Chemicals

CAS: 2206-27-1 Molekylær formel: C2H6OS Molekylvægt (g/mol): 84.17 MDL nummer: MFCD00002090 InChI nøgle: 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 navn: trideuterio(trideuteriomethylsulfinyl)methan SMIL: [2H]C([2H])([2H])S(=O)C([2H])([2H])[2H]

MDL nummer MFCD00002090
PubChem CID 75151
Molekylvægt (g/mol) 84.17
CAS 2206-27-1
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
SMIL [2H]C([2H])([2H])S(=O)C([2H])([2H])[2H]
IUPAC navn trideuterio(trideuteriomethylsulfinyl)methan
InChI nøgle IAZDPXIOMUYVGZ-WFGJKAKNSA-N
Molekylær formel C2H6OS
6

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

CAS: 2206-27-1 Molekylær formel: C2H6OS Molekylvægt (g/mol): 84.17 MDL nummer: MFCD00002090 InChI nøgle: 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 navn: trideuterio(trideuteriomethylsulfinyl)methan SMIL: [2H]C([2H])([2H])S(=O)C([2H])([2H])[2H]

MDL nummer MFCD00002090
PubChem CID 75151
Molekylvægt (g/mol) 84.17
CAS 2206-27-1
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
SMIL [2H]C([2H])([2H])S(=O)C([2H])([2H])[2H]
IUPAC navn trideuterio(trideuteriomethylsulfinyl)methan
InChI nøgle IAZDPXIOMUYVGZ-WFGJKAKNSA-N
Molekylær formel C2H6OS
7

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

CAS: 2206-27-1 Molekylær formel: C2H6OS Molekylvægt (g/mol): 84.17 MDL nummer: MFCD00002090 InChI nøgle: 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 SMIL: [2H]C([2H])([2H])S(=O)C([2H])([2H])[2H]

MDL nummer MFCD00002090
PubChem CID 75151
Molekylvægt (g/mol) 84.17
CAS 2206-27-1
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
SMIL [2H]C([2H])([2H])S(=O)C([2H])([2H])[2H]
InChI nøgle IAZDPXIOMUYVGZ-WFGJKAKNSA-N
Molekylær formel C2H6OS
8

Methylsulfoxid-d6, til NMR, 99,9 % atom D, Thermo Scientific Chemicals

CAS: 2206-27-1 Molekylær formel: C2H6OS Molekylvægt (g/mol): 84.17 MDL nummer: MFCD00002090 InChI nøgle: IAZDPXIOMUYVGZ-WFGJKAKNSA-N Synonym: methane-d3,sulfinylbis-9ci,dmso-d6,deuterated dmso,methane-d3, sulfinylbis,dimethyl-d6 sulfoxide,hexadeuterodimethyl sulfoxide,methanesulfinylmethyl hydrogen,dimethylsulfoxide-d6,methane-d3-, sulfinylbis,dimethyl sulfoxide-d6 PubChem CID: 75151 SMIL: [2H]C([2H])([2H])S(=O)C([2H])([2H])[2H]

MDL nummer MFCD00002090
PubChem CID 75151
Molekylvægt (g/mol) 84.17
CAS 2206-27-1
Synonym methane-d3,sulfinylbis-9ci,dmso-d6,deuterated dmso,methane-d3, sulfinylbis,dimethyl-d6 sulfoxide,hexadeuterodimethyl sulfoxide,methanesulfinylmethyl hydrogen,dimethylsulfoxide-d6,methane-d3-, sulfinylbis,dimethyl sulfoxide-d6
SMIL [2H]C([2H])([2H])S(=O)C([2H])([2H])[2H]
InChI nøgle IAZDPXIOMUYVGZ-WFGJKAKNSA-N
Molekylær formel C2H6OS
9

n-Hexane-d14, for NMR, 99+ atom % D

CAS: 21666-38-6 Molekylær formel: C6H14 Molekylvægt (g/mol): 100.26 MDL nummer: MFCD00037562 InChI nøgle: VLKZOEOYAKHREP-ZLKPZJALSA-N Synonym: hexane-d14,tetradecadeuterohexane,n-hexane-d 14,2h14 hexane,2 h?? hexane,hexane-d14, 99 atom % d PubChem CID: 140854 IUPAC navn: 1,1,1,2,2,3,3,4,4,5,5,6,6,6-tetradecadeuteriohexane SMIL: [2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])[2H]

MDL nummer MFCD00037562
PubChem CID 140854
Molekylvægt (g/mol) 100.26
CAS 21666-38-6
Synonym hexane-d14,tetradecadeuterohexane,n-hexane-d 14,2h14 hexane,2 h?? hexane,hexane-d14, 99 atom % d
SMIL [2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])[2H]
IUPAC navn 1,1,1,2,2,3,3,4,4,5,5,6,6,6-tetradecadeuteriohexane
InChI nøgle VLKZOEOYAKHREP-ZLKPZJALSA-N
Molekylær formel C6H14
10

Deuteriumoxid, til NMR, 100,0 % atom D, Thermo Scientific Chemicals

CAS: 7789-20-0 Molekylær formel: H2O Molekylvægt (g/mol): 20.03 MDL nummer: MFCD00044636 InChI nøgle: XLYOFNOQVPJJNP-ZSJDYOACSA-N Synonym: deuterium oxide,water-d2,heavy water,deuterated water,dideuterium oxide,heavy water-d2,heavy water d2o,water sup 2-h2,deuterium oxide usan,water, heavy d2-o PubChem CID: 24602 ChEBI: CHEBI:41981 IUPAC navn: [(²H)oxy](²H) SMIL: [2H]O[2H]

MDL nummer MFCD00044636
PubChem CID 24602
Molekylvægt (g/mol) 20.03
CAS 7789-20-0
ChEBI CHEBI:41981
Synonym deuterium oxide,water-d2,heavy water,deuterated water,dideuterium oxide,heavy water-d2,heavy water d2o,water sup 2-h2,deuterium oxide usan,water, heavy d2-o
SMIL [2H]O[2H]
IUPAC navn [(²H)oxy](²H)
InChI nøgle XLYOFNOQVPJJNP-ZSJDYOACSA-N
Molekylær formel H2O
12

Pyridin-d5, til NMR, 100,0 % atom D, Thermo Scientific Chemicals

CAS: 7291-22-7 Molekylær formel: C5H5N Molekylvægt (g/mol): 84.13 MDL nummer: MFCD00044639 InChI nøgle: 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 navn: 2,3,4,5,6-pentadeuteriopyridine SMIL: [2H]C1=NC([2H])=C([2H])C([2H])=C1[2H]

MDL nummer MFCD00044639
PubChem CID 558519
Molekylvægt (g/mol) 84.13
CAS 7291-22-7
Synonym pyridine-d5,2h5 pyridine,c5d5n,2 h? pyridine,pyridine d5,pyridine,crude,light,pyridine, perdeutero,∼2∼h_5_ pyridine,de85c
SMIL [2H]C1=NC([2H])=C([2H])C([2H])=C1[2H]
IUPAC navn 2,3,4,5,6-pentadeuteriopyridine
InChI nøgle JUJWROOIHBZHMG-RALIUCGRSA-N
Molekylær formel C5H5N
13

Chloroform-d, til NMR, 99,8 % atom D, stabiliseret med sølvfolie, Thermo Scientific Chemicals

CAS: 865-49-6 Molekylær formel: CHCl3 Molekylvægt (g/mol): 120.375 MDL nummer: MFCD00000827 InChI nøgle: 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 navn: trichlor(deuterio)methan SMIL: C(Cl)(Cl)Cl

MDL nummer MFCD00000827
PubChem CID 71583
Molekylvægt (g/mol) 120.375
CAS 865-49-6
ChEBI CHEBI:85365
Synonym chloroform-d,deuterochloroform,methane-d, trichloro,2h chloroform,deuterated chloroform,cdcl3,trichloromethane-d,unii-p1nw4885vt,trichloro deuterio methane,chloroform, deutero
SMIL C(Cl)(Cl)Cl
IUPAC navn trichlor(deuterio)methan
InChI nøgle HEDRZPFGACZZDS-MICDWDOJSA-N
Molekylær formel CHCl3
14

Methylsulfoxid-d6, til NMR, indeholder 1 v/v % TMS, 99,9 % atom D, Thermo Scientific Chemicals

CAS: 2206-27-1 Molekylær formel: C2H6OS Molekylvægt (g/mol): 84.17 MDL nummer: MFCD00002090 InChI nøgle: 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 navn: trideuterio(trideuteriomethylsulfinyl)methan SMIL: [2H]C([2H])([2H])S(=O)C([2H])([2H])[2H]

MDL nummer MFCD00002090
PubChem CID 75151
Molekylvægt (g/mol) 84.17
CAS 2206-27-1
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
SMIL [2H]C([2H])([2H])S(=O)C([2H])([2H])[2H]
IUPAC navn trideuterio(trideuteriomethylsulfinyl)methan
InChI nøgle IAZDPXIOMUYVGZ-WFGJKAKNSA-N
Molekylær formel C2H6OS
15

Methanol-d4, til NMR, 99,8 % atom D, Thermo Scientific Chemicals

CAS: 811-98-3 Molekylær formel: CH4O MDL nummer: MFCD00044637 InChI nøgle: 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

MDL nummer MFCD00044637
PubChem CID 71568
CAS 811-98-3
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
InChI nøgle OKKJLVBELUTLKV-MZCSYVLQSA-N
Molekylær formel CH4O