rac-1-((3S,3aS,4S,5S,7aS)-3-Hydroxy-5-isopropyl-7a-methyl-octahydro-1H-inden-4-yl)ethanone

rac-1-((3S,3aS,4S,5S,7aS)-3-Hydroxy-5-isopropyl-7a-methyl-octahydro-1H-inden-4-yl)ethanone

Common Name: rac-1-((3S,3aS,4S,5S,7aS)-3-Hydroxy-5-isopropyl-7a-methyl-octahydro-1H-inden-4-yl)ethanone

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C15H26O2/c1-9(2)11-5-7-15(4)8-6-12(17)14(15)13(11)10(3)16/h9,11-14,17H,5-8H2,1-4H3/t11-,12-,13-,14-,15-/m0/s1

InChIKey: InChIKey=UDIWPCMVTZJABP-YTFOTSKYSA-N

Formula: C15H26O2

Molecular Weight: 238.366308

Exact Mass: 238.19328

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Findley, T.J.K., Sucunza, D., Miller, L.C., Davies, D.T., Procter, D.J. Chem Eur J (2008) 14, 6862-5

Species:

Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Isoiphionanes; 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) 38.2
2 (CH2) 30.9
3 (CH) 72.9
4 (C) 215.7
5 (CH) 55.7
6 (CH) 50.7
7 (CH) 38.5
8 (CH2) 19.3
9 (CH2) 32.9
10 (C) 41.5
11 (CH) 28.1
12 (CH3) 21.5
13 (CH3) 15.9
14 (CH3) 24.8
15 (CH3) 31.9