Spektraris NMR

Common Name: 8-Oxo-11S-eremophil-6-en-12-oic acid

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C15H22O3/c1-9-5-4-6-11-7-13(16)12(8-15(9,11)3)10(2)14(17)18/h8-11H,4-7H2,1-3H3,(H,17,18)/t9-,10-,11+,15+/m0/s1

InChIKey: InChIKey=HGWXWGKXIKVBKD-KIGUWFBYSA-N

Formula: C15H22O3

Molecular Weight: 250.33395

Exact Mass: 250.156895

NMR Solvent: C6D6

MHz:

Calibration:

NMR references: 13C - Tori, M., Watanabe, A., Matsuo, S., Okamoto, Y., Tachikawa, K., Takaoka, S., Gong, X., Kuroda, C., Hanai, R. Tetrahedron (2008) 64, 4486-95

Species:

Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Eremophilanes; 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)