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4-Methylsalicylic acid

View entire compound with spectra: 12 NMR, 7 FTIR, 2 Raman, and 3 MS (GC)

4-Methylsalicylic acid
SpectraBase Compound ID KPDU1pd54v2
InChI InChI=1S/C8H8O3/c1-5-2-3-6(8(10)11)7(9)4-5/h2-4,9H,1H3,(H,10,11)
InChIKey NJESAXZANHETJV-UHFFFAOYSA-N
Mol Weight 152.15 g/mol
Molecular Formula C8H8O3
Exact Mass 152.047344 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8oIZv7gMMh9
Name 4-Methylsalicylic acid
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 244503
CAS Registry Number 50-85-1
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H8O3
InChI InChI=1S/C8H8O3/c1-5-2-3-6(8(10)11)7(9)4-5/h2-4,9H,1H3,(H,10,11)
InChIKey NJESAXZANHETJV-UHFFFAOYSA-N
Observed nucleus 1H
Purity 99%
Solvent CDCl3 & DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 2-Hydroxy-4-methylbenzoic acid m-Cresotic acid
Wiley ID SIAL_1HNMR_004028