Spektraris NMR

Common Name: Vanillic acid

Synonyms: Vanillic acid

CAS Registry Number:

InChI: InChI=1S/C8H8O4/c1-12-7-4-5(8(10)11)2-3-6(7)9/h2-4,9H,1H3,(H,10,11)

InChIKey: InChIKey=WKOLLVMJNQIZCI-UHFFFAOYSA-N

Formula: C8H8O4

Molecular Weight: 168.147033

Exact Mass: 168.042259

NMR Solvent: C-D

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)