For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

Succinic acid, 4-chloro-3-methylphenyl 3-fluorophenyl ester

View entire compound with spectra: 1 NMR, and 1 FTIR

Succinic acid, 4-chloro-3-methylphenyl 3-fluorophenyl ester
SpectraBase Compound ID DjiEEGZEb9m
InChI InChI=1S/C17H14ClFO4/c1-11-9-14(5-6-15(11)18)23-17(21)8-7-16(20)22-13-4-2-3-12(19)10-13/h2-6,9-10H,7-8H2,1H3
InChIKey UYUBSMRUVPIFRS-UHFFFAOYSA-N
Mol Weight 336.75 g/mol
Molecular Formula C17H14ClFO4
Exact Mass 336.056465 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID S8n5MaE6du
Name Succinic acid, 4-chloro-3-methylphenyl 3-fluorophenyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 336.056464790 u
Formula C17H14ClFO4
InChI InChI=1S/C17H14ClFO4/c1-11-9-14(5-6-15(11)18)23-17(21)8-7-16(20)22-13-4-2-3-12(19)10-13/h2-6,9-10H,7-8H2,1H3
InChIKey UYUBSMRUVPIFRS-UHFFFAOYSA-N
Molecular Weight 336.746 g/mol
SMILES C(CC(OC1=CC(C)=C(C=C1)Cl)=O)C(OC1=CC=CC(=C1)F)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.965795