4-Epieremophil-9-ene-11,12-diol

4-Epieremophil-9-ene-11,12-diol

Common Name: 4-Epieremophil-9-ene-11,12-diol

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C15H26O2/c1-11-5-4-6-12-7-8-13(9-14(11,12)2)15(3,17)10-16/h7,11,13,16-17H,4-6,8-10H2,1-3H3/t11-,13-,14-,15?/m1/s1

InChIKey: InChIKey=XJXXJYGANFEEDD-XIBUKWPUSA-N

Formula: C15H26O2

Molecular Weight: 238.366308

Exact Mass: 238.19328

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Watson, D.G., Rycroft, D.S., Freer, I.M., Brooks, C.J.W. Phytochemistry (1985) 24, 2195-200

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)

Carbon NMR Peaks

Position PPM
1 (CH2) 31.9
2 (CH2) 22.4
3 (CH2) 30.2
4 (CH) 41.5
5 (C) 38.6
6 (CH2) 38.4
7 (CH) 39.2
8 (CH2) 26.4
9 (CH) 120
10 (C) 141.6
11 (C) 74.4
12 (CH3) 20
13 (CH2) 68.5
14 (CH3) 30.3
15 (CH3) 17.7