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1-Methylindole-2-carboxylic acid

View entire compound with spectra: 5 NMR, 3 FTIR, 1 Raman, and 1 MS (GC)

1-Methylindole-2-carboxylic acid
SpectraBase Compound ID 3EdCpB79VG1
InChI InChI=1S/C10H9NO2/c1-11-8-5-3-2-4-7(8)6-9(11)10(12)13/h2-6H,1H3,(H,12,13)
InChIKey MAHAMBLNIDMREX-UHFFFAOYSA-N
Mol Weight 175.19 g/mol
Molecular Formula C10H9NO2
Exact Mass 175.063329 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID A8K9x90QA4X
Name 1-Methylindole-2-carboxylic acid
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 134155
CAS Registry Number 16136-58-6
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H9NO2
InChI InChI=1S/C10H9NO2/c1-11-8-5-3-2-4-7(8)6-9(11)10(12)13/h2-6H,1H3,(H,12,13)
InChIKey MAHAMBLNIDMREX-UHFFFAOYSA-N
Observed nucleus 13C
Purity 98%
Solvent CDCl3 & DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms NSC 68357
Wiley ID SIAL_13CNMR_000984