| SpectraBase Compound ID | CXr6OY5YEg |
|---|---|
| InChI | InChI=1S/C19H32O2/c1-21-19(20)17-11-9-7-5-3-2-4-6-8-10-14-18-15-12-13-16-18/h3,5,12,15,18H,2,4,6-11,13-14,16-17H2,1H3/b5-3+ |
| InChIKey | FWVHFWVSFHFRBX-HWKANZROSA-N |
| Mol Weight | 292.5 g/mol |
| Molecular Formula | C19H32O2 |
| Exact Mass | 292.24023 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2HS5oslQ7SD |
|---|---|
| Name | 6-Tridecenoic acid, 13-(2-cyclopenten-1-yl)-, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 292.240230268 u |
| Formula | C19H32O2 |
| InChI | InChI=1S/C19H32O2/c1-21-19(20)17-11-9-7-5-3-2-4-6-8-10-14-18-15-12-13-16-18/h3,5,12,15,18H,2,4,6-11,13-14,16-17H2,1H3/b5-3+ |
| InChIKey | FWVHFWVSFHFRBX-HWKANZROSA-N |
| SMILES | C(CC1CCC=C1)CCCC\C=C\CCCCC(OC)=O |