Spektraris NMR
(1S)-1alpha,8aalpha-Dimethyl-7beta-[(R)-1-methyl-1,2-dihydroxyethyl]-1,2,6,7,8,8a-hexahydronaphthalene-2-one
![(1S)-1alpha,8aalpha-Dimethyl-7beta-[(R)-1-methyl-1,2-dihydroxyethyl]-1,2,6,7,8,8a-hexahydronaphthalene-2-one](/nmr/static/nmr/svg/6741.svg)
Common Name: (1S)-1alpha,8aalpha-Dimethyl-7beta-[(R)-1-methyl-1,2-dihydroxyethyl]-1,2,6,7,8,8a-hexahydronaphthalene-2-one
Synonyms: (1S)-1alpha,8aalpha-Dimethyl-7beta-[(R)-1-methyl-1,2-dihydroxyethyl]-1,2,6,7,8,8a-hexahydronaphthalene-2-one
CAS Registry Number:
InChI: InChI=1S/C15H22O3/c1-10-13(17)7-6-11-4-5-12(8-14(10,11)2)15(3,18)9-16/h4,6-7,10,12,16,18H,5,8-9H2,1-3H3/t10-,12-,14+,15+/m1/s1
InChIKey: InChIKey=NBSVVLFADNHDAW-DWZYQQQCSA-N
Formula: C15H22O3
Molecular Weight: 250.33395
Exact Mass: 250.156895
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Han, Y.F., Pan, J., Gao, K., Jia, Z.J. Chem Pharm Bull (2005) 53, 1338-41
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Eremophilanes; 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) | 145.2 |
| 2 (CH) | 125.1 |
| 3 (C) | 201.5 |
| 4 (CH) | 52.6 |
| 5 (C) | 39.4 |
| 6 (CH2) | 35.1 |
| 7 (CH) | 35.6 |
| 8 (CH2) | 27.7 |
| 9 (CH) | 132.5 |
| 10 (C) | 141.3 |
| 11 (C) | 74.1 |
| 12 (CH2) | 68.5 |
| 13 (CH3) | 19.6 |
| 14 (CH3) | 19.2 |
| 15 (CH3) | 7.2 |
