EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C2D6O |
| Net Charge | 0 |
| Average Mass | 52.106 |
| Monoisotopic Mass | 52.07953 |
| SMILES | [2H]OC([2H])([2H])C([2H])([2H])[2H] |
| InChI | InChI=1S/C2H6O/c1-2-3/h3H,2H2,1H3/i1D3,2D2,3D |
| InChIKey | LFQSCWFLJHTTHZ-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 ethanol | SUBMITTER |
| ethyl-d5 alcohol-d | SUBMITTER |
| hexadeuteroethanol | SUBMITTER |
| Manual Xrefs | Databases |
|---|---|
| https://en.wikipedia.org/wiki/Deuterated_ethanol | Wikipedia |
| Registry Numbers | Sources |
|---|---|
| CAS:1516-08-1 | SUBMITTER |