SpectraBase Spectrum ID |
8XoqV0xwCX6 |
Name |
Succinic acid, 2-chloro-6-fluorophenyl 3-phenylprop-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 |
362.072114854 u |
Formula |
C19H16ClFO4 |
InChI |
InChI=1S/C19H16ClFO4/c20-15-9-4-10-16(21)19(15)25-18(23)12-11-17(22)24-13-5-8-14-6-2-1-3-7-14/h1-10H,11-13H2/b8-5+ |
InChIKey |
FUMADRXELDDAQT-VMPITWQZSA-N |
Molecular Weight |
362.784 g/mol |
SMILES |
C(CC(OC1=C(C=CC=C1F)Cl)=O)C(OC\C=C\C1=CC=CC=C1)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.946137 |