CHEBI:193043 - ethanol-d6

ChEBI IDCHEBI:193043
ChEBI Nameethanol-d6
Stars
Last Modified18 October 2023
SubmitterJohannes Hunold (ORCID: 0000-0002-4378-6061)
DownloadsMolfile
FormulaC2D6O
Net Charge0
Average Mass52.106
Monoisotopic Mass52.07953
SMILES[2H]OC([2H])([2H])C([2H])([2H])[2H]
InChIInChI=1S/C2H6O/c1-2-3/h3H,2H2,1H3/i1D3,2D2,3D
InChIKeyLFQSCWFLJHTTHZ-LIDOUZCJSA-N
Wikipedia
Roles Classification
Chemical Role:
NMR solvent  A solvent used in nuclear magnetic resonance (NMR) spectroscopy.
Application:
NMR solvent  A solvent used in nuclear magnetic resonance (NMR) spectroscopy.
ChEBI Ontology
Outgoing Relation(s)
ethanol-d6 (CHEBI:193043) has role NMR solvent (CHEBI:197449)
ethanol-d6 (CHEBI:193043) is a alkyl alcohol (CHEBI:50584)
ethanol-d6 (CHEBI:193043) is a deuterated compound (CHEBI:76107)
ethanol-d6 (CHEBI:193043) is a ethanols (CHEBI:23982)
ethanol-d6 (CHEBI:193043) is a volatile organic compound (CHEBI:134179)
IUPAC Name 
1,1,1,2,2-pentadeuterio-2-deuteriooxyethane
Synonyms  Source
deuterated ethanolSUBMITTER
ethyl-d5 alcohol-dSUBMITTER
hexadeuteroethanolSUBMITTER
Registry NumbersSources
CAS:1516-08-1SUBMITTER