| SpectraBase Compound ID | SPPcva67rE |
|---|---|
| InChI | InChI=1S/C7H12O/c1-3-5-7(8)6-4-2/h1,7-8H,4-6H2,2H3 |
| InChIKey | LYXYBSYXGARUEA-UHFFFAOYSA-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 | DEPKaBU0b33 |
|---|---|
| Name | 1-Heptyn-4-ol |
| CAS Registry Number | 22127-83-9 |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H12O |
| InChI | InChI=1S/C7H12O/c1-3-5-7(8)6-4-2/h1,7-8H,4-6H2,2H3 |
| InChIKey | LYXYBSYXGARUEA-UHFFFAOYSA-N |
| Molecular Weight | 112.172 g/mol |
| SMILES | OC(CC#C)CCC |
| SPLASH | splash10-0596-9000000000-1ee87d687a290b5fda93 |
| Source of Spectrum | HE-1982-0-0 |
| Synonyms | Hept-1-yn-4-ol |
| Wiley ID | 1123388 |