| SpectraBase Compound ID | 3rS83DDu1hU |
|---|---|
| InChI | InChI=1S/C7H12O/c1-3-5-7(8)6-4-2/h7-8H,3,5H2,1-2H3/t7-/m1/s1 |
| InChIKey | AYFRKLSJSAVMRG-SSDOTTSWSA-N |
| Mol Weight | 112.17 g/mol |
| Molecular Formula | C7H12O |
| Exact Mass | 112.088815 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Kz74AnOMZhv |
|---|---|
| Name | (4R)-Hept-2-yn-4-ol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H12O |
| InChI | InChI=1S/C7H12O/c1-3-5-7(8)6-4-2/h7-8H,3,5H2,1-2H3/t7-/m1/s1 |
| InChIKey | AYFRKLSJSAVMRG-SSDOTTSWSA-N |
| Literature Reference DOI | 10.1021/ol801708x |
| Molecular Weight | 112.172 g/mol |
| SMILES | O[C@](CCC)(C#CC)[H] |
| SPLASH | splash10-014i-9000000000-72442c5c39fc98f31d81 |
| Source of Spectrum | A1-10-4489/SMS18-29 |
| Synonyms | (R)-hept-2-yn-4-ol |
| Wiley ID | 1759849 |