| SpectraBase Compound ID | HvYwQKH2ySE |
|---|---|
| InChI | InChI=1S/C7H12O2/c1-3-7(9)5-4-6(2)8/h4-6,8H,3H2,1-2H3/b5-4+/t6-/m0/s1 |
| InChIKey | CPMIUWPZZHMLEY-OVCGOVNKSA-N |
| Mol Weight | 128.17 g/mol |
| Molecular Formula | C7H12O2 |
| Exact Mass | 128.08373 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 75eHqE2bEmb |
|---|---|
| Name | (S)-5-Oxo-hept-3-en-2-ol |
| Alternate Name(s) | (4E,6S)-6-hydroxy-4-hepten-3-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H12O2 |
| InChI | InChI=1S/C7H12O2/c1-3-7(9)5-4-6(2)8/h4-6,8H,3H2,1-2H3/b5-4+/t6-/m0/s1 |
| InChIKey | CPMIUWPZZHMLEY-OVCGOVNKSA-N |
| Molecular Weight | 128.171 g/mol |
| SMILES | O[C@](\C=C\C(=O)CC)(C)[H] |
| SPLASH | splash10-0002-9200000000-0c3034b893d6b87634b4 |
| Source of Spectrum | AT-31-4138-14 |
| Wiley ID | 835786 |