| SpectraBase Compound ID | DHqmmsFfosh |
|---|---|
| InChI | InChI=1S/C19H36O/c1-4-5-6-7-8-9-10-11-12-13-16-19(20)17-14-15-18(2)3/h18-20H,4-12,14-15,17H2,1-3H3 |
| InChIKey | HSQCFTNPHIPOGG-UHFFFAOYSA-N |
| Mol Weight | 280.5 g/mol |
| Molecular Formula | C19H36O |
| Exact Mass | 280.276616 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | GcyTzuN9JaS |
|---|---|
| Name | 2-Methyl-7-octadecyn-6-ol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 280.276615778 u |
| Formula | C19H36O |
| InChI | InChI=1S/C19H36O/c1-4-5-6-7-8-9-10-11-12-13-16-19(20)17-14-15-18(2)3/h18-20H,4-12,14-15,17H2,1-3H3 |
| InChIKey | HSQCFTNPHIPOGG-UHFFFAOYSA-N |
| SMILES | C(#CCCCCCCCCCC)C(O)CCCC(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.914495 |