SpectraBase Compound ID | 7nInDQgs0q4 |
---|---|
InChI | InChI=1S/C17H32O2/c1-4-5-6-7-8-9-10-11-12-13-14-16(2)15-19-17(3)18/h13-14,16H,4-12,15H2,1-3H3/b14-13+ |
InChIKey | DUZNCIPEVHBOHE-BUHFOSPRSA-N |
Mol Weight | 268.4 g/mol |
Molecular Formula | C17H32O2 |
Exact Mass | 268.24023 g/mol |
SpectraBase Spectrum ID | HyJ5n0RXdV3 |
---|---|
Name | E-2-Methyl-3-tetradecen-1-ol acetate |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 268.240230268 u |
Formula | C17H32O2 |
InChI | InChI=1S/C17H32O2/c1-4-5-6-7-8-9-10-11-12-13-14-16(2)15-19-17(3)18/h13-14,16H,4-12,15H2,1-3H3/b14-13+ |
InChIKey | DUZNCIPEVHBOHE-BUHFOSPRSA-N |
SMILES | C(CCCCCCC\C=C\C(COC(=O)C)C)CC |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.937265 |