| SpectraBase Compound ID | HaUa8msMg94 |
|---|---|
| InChI | InChI=1S/C6H10O2/c1-2-6(8)4-3-5-7/h5H,2-4H2,1H3/i2D2,4D2 |
| InChIKey | KKOFYQBBUSZDKJ-BYUTVXSXSA-N |
| Mol Weight | 118.17 g/mol |
| Molecular Formula | C6H6D4O2 |
| Exact Mass | 118.093187 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 1iI6quE8MNB |
|---|---|
| Name | 4-Oxo-3,3,5,5-tetradeuteriohexanal |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H6D4O2 |
| InChI | InChI=1S/C6H10O2/c1-2-6(8)4-3-5-7/h5H,2-4H2,1H3/i2D2,4D2 |
| InChIKey | KKOFYQBBUSZDKJ-BYUTVXSXSA-N |
| Molecular Weight | 118.168 g/mol |
| SMILES | C(=O)(C(CC=O)([D])[D])C(C)([D])[D] |
| SPLASH | splash10-014r-5900000000-952777b9150f79bc74b7 |
| Source of Spectrum | CRT-8-235-4-d4 |
| Wiley ID | 1709469 |