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Glutaric acid, 3-chlorophenyl 2-methylphenyl ester

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

Glutaric acid, 3-chlorophenyl 2-methylphenyl ester
SpectraBase Compound ID 1L0H12EVAVN
InChI InChI=1S/C18H17ClO4/c1-13-6-2-3-9-16(13)23-18(21)11-5-10-17(20)22-15-8-4-7-14(19)12-15/h2-4,6-9,12H,5,10-11H2,1H3
InChIKey UWPYOYFNRTZRDU-UHFFFAOYSA-N
Mol Weight 332.78 g/mol
Molecular Formula C18H17ClO4
Exact Mass 332.081537 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID CKWIjXXU4K9
Name Glutaric acid, 3-chlorophenyl 2-methylphenyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 332.081536723 u
Formula C18H17ClO4
InChI InChI=1S/C18H17ClO4/c1-13-6-2-3-9-16(13)23-18(21)11-5-10-17(20)22-15-8-4-7-14(19)12-15/h2-4,6-9,12H,5,10-11H2,1H3
InChIKey UWPYOYFNRTZRDU-UHFFFAOYSA-N
Molecular Weight 332.783 g/mol
SMILES C(CCC(OC1=CC(=CC=C1)Cl)=O)C(OC=1C(C)=CC=CC1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.961654