| SpectraBase Compound ID | G7q3JlxNtq8 |
|---|---|
| InChI | InChI=1S/C7H12O/c1-3-5-6-7(8)4-2/h2,7-8H,3,5-6H2,1H3 |
| InChIKey | SHSFXAVQBIEYMK-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 | 5J5CgsFpklU |
|---|---|
| Name | 1-Heptyn-3-ol |
| Alternate Name(s) | Hept-1-yn-3-ol AI3-37262 |
| CAS Registry Number | 7383-19-9 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C7H12O |
| InChI | InChI=1S/C7H12O/c1-3-5-6-7(8)4-2/h2,7-8H,3,5-6H2,1H3 |
| InChIKey | SHSFXAVQBIEYMK-UHFFFAOYSA-N |
| Molecular Weight | 112.172 g/mol |
| SMILES | OC(CCCC)C#C |
| SPLASH | splash10-0a6r-9000000000-1d632b62e337ca10f221 |
| Source of Spectrum | NP-0-3517-0 |
| Wiley ID | 1095404 |