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Indole-3-carboxylic acid

View entire compound with spectra: 13 NMR, 2 FTIR, 1 Raman, 3 UV-Vis, and 2 MS (GC)

Indole-3-carboxylic acid
SpectraBase Compound ID 6WlNgx4sXph
InChI InChI=1S/C9H7NO2/c11-9(12)7-5-10-8-4-2-1-3-6(7)8/h1-5,10H,(H,11,12)
InChIKey KMAKOBLIOCQGJP-UHFFFAOYSA-N
Mol Weight 161.16 g/mol
Molecular Formula C9H7NO2
Exact Mass 161.047678 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5znWb0ImFe5
Name Indole-3-carboxylic acid
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 284734
CAS Registry Number 771-50-6
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H7NO2
InChI InChI=1S/C9H7NO2/c11-9(12)7-5-10-8-4-2-1-3-6(7)8/h1-5,10H,(H,11,12)
InChIKey KMAKOBLIOCQGJP-UHFFFAOYSA-N
Observed nucleus 13C
Purity 99%
Solvent DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms beta-Indolylcarboxylic acid; 3-Carboxyindole; 3-Indole formic acid; 3-Indolylcarboxylic acid; Indole-beta-carboxylic acid
Wiley ID SIAL_13CNMR_005345