SpectraBase Spectrum ID |
Dhw95EfSExf |
Name |
p-Anisic acid, undec-2-enyl ester |
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/c1-3-4-5-6-7-8-9-10-11-16-22-19(20)17-12-14-18(21-2)15-13-17/h10-15H,3-9,16H2,1-2H3/b11-10+ |
InChIKey |
MGXSEOKEPVJKMF-ZHACJKMWSA-N |
Molecular Weight |
304.430 g/mol |
SMILES |
C1=C(C=CC(=C1)C(=O)OC\C=C\CCCCCCCC)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.806324 |