| SpectraBase Compound ID | ceXjXDiegl |
|---|---|
| InChI | InChI=1S/C7H12O/c1-3-4-5-6-7(2)8/h1,7-8H,4-6H2,2H3/t7-/m0/s1 |
| InChIKey | UUVYQHRAOICJTA-ZETCQYMHSA-N |
| Mol Weight | 112.17 g/mol |
| Molecular Formula | C7H12O |
| Exact Mass | 112.088815 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | CsyewqGfz7X |
|---|---|
| Name | (S)-hept-6-yn-2-ol |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H12O |
| InChI | InChI=1S/C7H12O/c1-3-4-5-6-7(2)8/h1,7-8H,4-6H2,2H3/t7-/m0/s1 |
| InChIKey | UUVYQHRAOICJTA-ZETCQYMHSA-N |
| Literature Reference DOI | 10.1021/ol800137f |
| Molecular Weight | 112.172 g/mol |
| SMILES | O[C@@](C)(CCCC#C)[H] |
| SPLASH | splash10-00kb-9000000000-c47ce4cdfa0dc003c89c |
| Source of Spectrum | A1-10-1533/SMS7-16 |
| Synonyms | (2S)-6-heptyn-2-ol |
| Wiley ID | 1759266 |