Spektraris NMR

Common Name: 2-Hexylidene-3-methylsuccinic acid

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C11H18O4/c1-3-4-5-6-7-9(11(14)15)8(2)10(12)13/h7-8H,3-6H2,1-2H3,(H,12,13)(H,14,15)/b9-7+

InChIKey: InChIKey=YTUQECDNJQCQAE-VQHVLOKHSA-N

Formula: C11H18O4

Molecular Weight: 214.258648

Exact Mass: 214.120509

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Chinworrungsee, M., P.Kittakoop, Isaka, M., Rungrod, A., Tanticharoen, M., Thebtaranonth, Y. Bioorg Med Chem Lett (2001) 11, 1965-9

Species:

Notes: Family : Aliphatics, Type : Acids; 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)