Mononorvalerenone

Mononorvalerenone

Common Name: Mononorvalerenone

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C14H22O2/c1-9-4-5-11(8-10(2)15)14-12(9)6-7-13(14,3)16-14/h9,11-12H,4-8H2,1-3H3/t9-,11+,12-,13+,14-/m1/s1

InChIKey: InChIKey=VESROWPDCSMBRM-RMTQGBGSSA-N

Formula: C14H22O2

Molecular Weight: 222.323809

Exact Mass: 222.16198

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Wang, P.C., Hu, J.M., Ran, X.H., Chen, Z.Q., Jiang, H.Z., Liu, Y.Q., Zhou, J., Zhao, Y.X. J Nat Prod (2009) 72, 1682-5

Species:

Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Valerenanes; 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 (CH) 40.9
2 (CH2) 23.9
3 (CH2) 32.8
4 (C) 71.8
5 (C) 72
6 (CH) 30.4
7 (CH2) 43.7
8 (CH2) 23.6
9 (CH2) 26.6
10 (CH) 32.7
11 (C) 208.3
12 (CH3) 30.1
14 (CH3) 13.8
15 (CH3) 15