| SpectraBase Spectrum ID |
IUyyQDNUtmL |
| Name |
8-[3-[(E)-oct-2-Enyl]-2-oxiranyl]octanoic acid methyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
310.250794952 u |
| Formula |
C19H34O3 |
| InChI |
InChI=1S/C19H34O3/c1-3-4-5-6-8-11-14-17-18(22-17)15-12-9-7-10-13-16-19(20)21-2/h8,11,17-18H,3-7,9-10,12-16H2,1-2H3/b11-8+ |
| InChIKey |
JCJMEMDHUZYVMB-DHZHZOJOSA-N |
| SMILES |
C(CCCCCCCC1C(C\C=C\CCCCC)O1)(=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.96968 |
![8-[3-[(E)-oct-2-enyl]-2-oxiranyl]octanoic acid methyl ester](/api/spectrum/IUyyQDNUtmL/structure.png?h=300&w=458 "8-[3-[(E)-oct-2-enyl]-2-oxiranyl]octanoic acid methyl ester")
