| SpectraBase Compound ID | GbgMlRBFwfS |
|---|---|
| InChI | InChI=1S/C6H12O2/c1-2-3-4-5-6(7)8/h2-5H2,1H3,(H,7,8)/i2D,5D |
| InChIKey | FUZZWVXGSFPDMH-GSUVGXDCSA-N |
| Mol Weight | 118.17 g/mol |
| Molecular Formula | C6H10D2O2 |
| Exact Mass | 118.096283 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4x73C1c22O |
|---|---|
| Name | 2,5-Dideuteriohexanoic acid |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H10D2O2 |
| InChI | InChI=1S/C6H12O2/c1-2-3-4-5-6(7)8/h2-5H2,1H3,(H,7,8)/i2D,5D |
| InChIKey | FUZZWVXGSFPDMH-GSUVGXDCSA-N |
| Molecular Weight | 118.172 g/mol |
| SMILES | OC(C(CCC(C)[D])[D])=O |
| SPLASH | splash10-03k9-9000000000-4714b25f40908a1d45a0 |
| Source of Spectrum | QF-8-4497-14 |
| Wiley ID | 1558037 |