Spektraris NMR

Common Name: 1,4-Dimethyl-1,2,3,3aalpha,4,5,6,8aalpha-octahydroazulene-1beta,4beta-diol

Synonyms: 1,4-Dimethyl-1,2,3,3aalpha,4,5,6,8aalpha-octahydroazulene-1beta,4beta-diol

CAS Registry Number:

InChI: InChI=1S/C12H20O2/c1-11(13)7-4-3-5-9-10(11)6-8-12(9,2)14/h3,5,9-10,13-14H,4,6-8H2,1-2H3/t9-,10-,11+,12+/m1/s1

InChIKey: InChIKey=OYLMHCZNXIBJBA-WYUUTHIRSA-N

Formula: C12H20O2

Molecular Weight: 196.286456

Exact Mass: 196.14633

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Xiang, Y., Fan, C.Q., Yue, J.M. Helv Chim Acta (2005) 88, 160-70

Species:

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