SpectraBase Spectrum ID |
JWVEILZDlK9 |
Name |
Succinic acid, 2-fluorophenyl cis-pent-2-en-1-yl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
280.111087186 u |
Formula |
C15H17FO4 |
InChI |
InChI=1S/C15H17FO4/c1-2-3-6-11-19-14(17)9-10-15(18)20-13-8-5-4-7-12(13)16/h3-8H,2,9-11H2,1H3/b6-3- |
InChIKey |
IPBHQNVRPWIWJG-UTCJRWHESA-N |
Molecular Weight |
280.295 g/mol |
SMILES |
C(CC(OC1=CC=CC=C1F)=O)C(OC\C=C/CC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.898409 |