| SpectraBase Compound ID | B2aOGHAKXBW |
|---|---|
| InChI | InChI=1S/C7H12O2/c8-7-5-3-1-2-4-6-9-7/h1-6H2/i5D2,6D2 |
| InChIKey | BTLSLHNLDQCWKS-NZLXMSDQSA-N |
| Mol Weight | 132.2 g/mol |
| Molecular Formula | C7H8D4O2 |
| Exact Mass | 132.108837 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | LsIctBHJQu4 |
|---|---|
| Name | 2-Oxocanone-3,3,8,8-D4 |
| CAS Registry Number | 137435-12-2 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H8D4O2 |
| InChI | InChI=1S/C7H12O2/c8-7-5-3-1-2-4-6-9-7/h1-6H2/i5D2,6D2 |
| InChIKey | BTLSLHNLDQCWKS-NZLXMSDQSA-N |
| Molecular Weight | 132.195 g/mol |
| SMILES | C1(OC(CCCCC1([D])[D])([D])[D])=O |
| SPLASH | splash10-05fr-9200000000-582a1cfdf2e43b805f84 |
| Source of Spectrum | J-57-297-2 |
| Wiley ID | 1131433 |