| SpectraBase Compound ID | ERApvU16PfC |
|---|---|
| InChI | InChI=1S/C7H12O/c1-2-3-4-5-6-7-8/h8H,2-4,7H2,1H3 |
| InChIKey | OGDYROFIIXDTQK-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 | FeDmP6iTiP4 |
|---|---|
| Name | 2-HEPTYN-1-OL |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass | 112.088815005 u |
| Formula | C7H12O |
| InChI | InChI=1S/C7H12O/c1-2-3-4-5-6-7-8/h8H,2-4,7H2,1H3 |
| InChIKey | OGDYROFIIXDTQK-UHFFFAOYSA-N |
| Molecular Weight | 112.172 g/mol |
| Nominal Mass | 112 u |
| Number of Peaks | 58 |
| SMILES | CCCCC#CCO |
| SPLASH | splash10-054o-9000000000-8c2775c8bfb37177056c |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |
| Wiley ID | MVX_001480 |