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alpha-Carboxy-o-toluic acid

View entire compound with spectra: 5 NMR, 4 FTIR, 1 Raman, and 2 MS (GC)

alpha-Carboxy-o-toluic acid
SpectraBase Compound ID JdlB5BSWM2O
InChI InChI=1S/C9H8O4/c10-8(11)5-6-3-1-2-4-7(6)9(12)13/h1-4H,5H2,(H,10,11)(H,12,13)
InChIKey ZHQLTKAVLJKSKR-UHFFFAOYSA-N
Mol Weight 180.16 g/mol
Molecular Formula C9H8O4
Exact Mass 180.042259 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID KY6D0Z023v0
Name Homophthalic acid
Source of Sample Aldrich
Catalog Number H16205
CAS Registry Number 89-51-0
Classification Aromatic carboxylic acids
Copyright Copyright © 2018-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H8O4
InChI InChI=1S/C9H8O4/c10-8(11)5-6-3-1-2-4-7(6)9(12)13/h1-4H,5H2,(H,10,11)(H,12,13)
InChIKey ZHQLTKAVLJKSKR-UHFFFAOYSA-N
Purity 98%
Solvent Nujol
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms alpha-Carboxy-o-toluic acid 2-Carboxyphenylacetic acid
Technique Mull
Wiley ID SIAL_FTIR_1_9961