Spektraris NMR
(1R)-6alpha-Isopropyl-1,2,6,7,8,8a-hexahydro-4,8abeta-dimethylnaphthalene-1beta,2alpha-diol
Common Name: (1R)-6alpha-Isopropyl-1,2,6,7,8,8a-hexahydro-4,8abeta-dimethylnaphthalene-1beta,2alpha-diol
Synonyms: (1R)-6alpha-Isopropyl-1,2,6,7,8,8a-hexahydro-4,8abeta-dimethylnaphthalene-1beta,2alpha-diol
CAS Registry Number:
InChI: InChI=1S/C15H24O2/c1-9(2)11-5-6-15(4)12(8-11)10(3)7-13(16)14(15)17/h7-9,11,13-14,16-17H,5-6H2,1-4H3/t11-,13-,14+,15+/m1/s1
InChIKey: InChIKey=UNJJBVJUBFDZLZ-RZFFKMDDSA-N
Formula: C15H24O2
Molecular Weight: 236.350426
Exact Mass: 236.17763
NMR Solvent: C6D6
MHz:
Calibration:
NMR references: 13C - Fattorusso, E., Santelia, F.U., Appendino, G., Ballero, M., Taglialatela-Scafati, O. J Nat Prod (2004) 67, 37-41
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)
Carbon NMR Peaks
| Position | PPM |
|---|---|
| 1 (CH) | 81.2 |
| 2 (CH) | 70.9 |
| 3 (CH) | 125.5 |
| 4 (C) | 132.8 |
| 5 (C) | 141.4 |
| 6 (CH) | 126.9 |
| 7 (CH) | 39.7 |
| 8 (CH2) | 20 |
| 9 (CH2) | 31 |
| 10 (C) | 37.7 |
| 11 (CH) | 32.9 |
| 12 (CH3) | 20.1 |
| 13 (CH3) | 20.2 |
| 14 (CH3) | 16.6 |
| 15 (CH3) | 19.1 |
