3,3,7-Trimethyltricyclo[5.4.0.02,9]undecan-8-one

3,3,7-Trimethyltricyclo[5.4.0.02,9]undecan-8-one

Common Name: 3,3,7-Trimethyltricyclo[5.4.0.02,9]undecan-8-one

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C14H22O/c1-13(2)7-4-8-14(3)10-6-5-9(11(10)13)12(14)15/h9-11H,4-8H2,1-3H3/t9-,10-,11+,14+/m0/s1

InChIKey: InChIKey=SXPTWBDKLVMRLI-KZWBYHQPSA-N

Formula: C14H22O1

Molecular Weight: 206.324404

Exact Mass: 206.167065

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Karimi, S., Tavares, P. J Nat Prod (2003) 66, 520-3

Species:

Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Longifolanes; 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) 51
2 (C) 225.7
3 (C) 48.2
4 (CH2) 40.2
5 (CH2) 20.1
6 (CH2) 36.7
7 (CH) 60.6
8 (CH3) 25.3
9 (C) 33.5
10 (CH3) 30.9
11 (CH3) 29.1
13 (CH) 42.9
14 (CH2) 25.2
15 (CH2) 25.2