Salicylic acid

Salicylic acid

Common Name: Salicylic acid

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C7H6O3/c8-6-4-2-1-3-5(6)7(9)10/h1-4,8H,(H,9,10)

InChIKey: InChIKey=YGSDEFSMJLZEOE-UHFFFAOYSA-N

Formula: C7H6O3

Molecular Weight: 138.121011

Exact Mass: 138.031694

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Bilia, A.R.,Yusuf, A.W.,Braca, A.,Keita, A.,Morelli, I. J Nat Prod (2000) 63, 16-21

Species:

Notes: Family : Aromatics, Type : Benzenes; 13 C Spectrum from Naproc 13: José Luis López-Pérez, Roberto Therón, Esther del Olmo, David Díaz: NAPROC-13: a database for the dereplication of natural product mixtures in bioassay-guided protocols. Bioinformatics 23(23):3256-3257 (2007)

Carbon NMR Peaks

Position PPM
1 (C) 114.4
2 (C) 162.9
3 (CH) 118.4
4 (CH) 136.7
5 (CH) 120.3
6 (CH) 131.7
7 (C) 173.6