| SpectraBase Spectrum ID |
IM8oICRmYyg |
| Name |
Succinic acid, 2-chloro-6-fluorophenyl 4-biphenyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
398.072114854 u |
| Formula |
C22H16ClFO4 |
| InChI |
InChI=1S/C22H16ClFO4/c23-18-7-4-8-19(24)22(18)28-21(26)14-13-20(25)27-17-11-9-16(10-12-17)15-5-2-1-3-6-15/h1-12H,13-14H2 |
| InChIKey |
LYMKUQOTKSJLCF-UHFFFAOYSA-N |
| Molecular Weight |
398.817 g/mol |
| SMILES |
C(CC(OC1=C(C=CC=C1F)Cl)=O)C(OC1=CC=C(C2=CC=CC=C2)C=C1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.914994 |
