![[1,1-D2]-1-Hydroxy-3-hexenone](/api/spectrum/HtntlFX9ej0/structure.png?h=300&w=458 "[1,1-D2]-1-Hydroxy-3-hexenone")
| SpectraBase Compound ID | Atm9upw4MFt |
|---|---|
| InChI | InChI=1S/C6H12O2/c1-2-3-6(8)4-5-7/h7H,2-5H2,1H3/i5D2 |
| InChIKey | ITHSWIXXHGKFJW-BFWBPSQCSA-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 | HtntlFX9ej0 |
|---|---|
| Name | [1,1-D2]-1-Hydroxy-3-hexenone |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H10D2O2 |
| InChI | InChI=1S/C6H12O2/c1-2-3-6(8)4-5-7/h7H,2-5H2,1H3/i5D2 |
| InChIKey | ITHSWIXXHGKFJW-BFWBPSQCSA-N |
| Molecular Weight | 118.172 g/mol |
| SMILES | OC(CC(=O)CCC)([D])[D] |
| SPLASH | splash10-0a4l-9000000000-6d92dfdc35a1ef2edc69 |
| Source of Spectrum | F-53-9211-0 |
| Wiley ID | 802712 |