| SpectraBase Spectrum ID |
4TIPixZOGIW |
| Name |
Ethyl 10,11-epoxy-11-phenylundecanoate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
304.203844759 u |
| Formula |
C19H28O3 |
| InChI |
InChI=1S/C19H28O3/c1-2-21-18(20)15-11-6-4-3-5-10-14-17-19(22-17)16-12-8-7-9-13-16/h7-9,12-13,17,19H,2-6,10-11,14-15H2,1H3 |
| InChIKey |
CBYIPKUWZSYAOU-UHFFFAOYSA-N |
| Molecular Weight |
304.430 g/mol |
| SMILES |
C1(OC1CCCCCCCCC(=O)OCC)C1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.968391 |