(1S,2Z,3aS,5aS,6R,8aR)-1,3a,4,5,5a,6,7,8-octahydro-1,3a,6-trimethylcyclopenta[c]pentalen-2-yl]methyl acetate

(1S,2Z,3aS,5aS,6R,8aR)-1,3a,4,5,5a,6,7,8-octahydro-1,3a,6-trimethylcyclopenta[c]pentalen-2-yl]methyl acetate

Common Name: (1S,2Z,3aS,5aS,6R,8aR)-1,3a,4,5,5a,6,7,8-octahydro-1,3a,6-trimethylcyclopenta[c]pentalen-2-yl]methyl acetate

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C17H26O2/c1-11-5-8-17-12(2)14(10-19-13(3)18)9-16(17,4)7-6-15(11)17/h9,11-12,15H,5-8,10H2,1-4H3/t11-,12-,15+,16+,17?/m1/s1

InChIKey: InChIKey=DBFAFFLIAHUBBF-RRIKORHPSA-N

Formula: C17H26O2

Molecular Weight: 262.38778

Exact Mass: 262.19328

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Dobner, M.J., Ellmerer, E.P., Schwaiger, S., Batsugkh, O., Narantuya, S., Stutz, M., Stuppner, H. Helv Chim Acta (2003) 86, 733-8

Species:

Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Silphiperfolianes; 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 (C) 65.6
2 (CH2) 34.8
3 (CH2) 37.6
4 (CH) 42.7
5 (CH) 52.5
6 (CH2) 30.2
7 (CH2) 36.2
8 (C) 57.1
9 (CH) 137.4
10 (C) 139.4
11 (CH) 48.9
12 (CH3) 19.8
13 (CH3) 20.2
14 (CH2) 62.1
15 (CH3) 14.2
14a (C) 170.9
14b (CH3) 21.1