Common Name: (4αS*,8S*)-5,6,7,8-Tetrahydro-4α,8-dimethylnaphthalen-2(4αH)-one
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C12H16O/c1-9-4-3-6-12(2)7-5-10(13)8-11(9)12/h5,7-9H,3-4,6H2,1-2H3/t9-,12-/m0/s1
InChIKey: InChIKey=SPNLYFPIWOEXSG-CABZTGNLSA-N
Formula: C12H16O1
Molecular Weight: 176.255288
Exact Mass: 176.120115
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Cheng, S.Y., Wen, Z.H., Wang, S.K., Chiang, M.Y., El-Gamal, A.A., Dai, C.F., Duh, C.Y. Chem Biodiversity (2009) 6, 86-95
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Eudesmanes; 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)
Position | PPM |
---|---|
1 (CH2) | 38.5 |
2 (CH2) | 21 |
3 (CH2) | 37 |
4 (CH) | 34.1 |
5 (C) | 171 |
6 (CH) | 121.5 |
7 (C) | 187.5 |
8 (CH) | 126.4 |
9 (CH) | 158.1 |
10 (C) | 41.2 |
14 (CH3) | 23.4 |
15 (CH3) | 17.7 |