Spektraris NMR
cis-Sativenediol
Common Name: cis-Sativenediol
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H24O2/c1-7(2)9-5-6-15(4)8(3)10-11(9)12(15)14(17)13(10)16/h7,9-14,16-17H,3,5-6H2,1-2,4H3/t9-,10+,11-,12-,13+,14-,15+/m1/s1
InChIKey: InChIKey=WESKDXUXCFNPHE-NRFRHTMUSA-N
Formula: C15H24O2
Molecular Weight: 236.350426
Exact Mass: 236.17763
NMR Solvent: CD3OD
MHz:
Calibration:
NMR references: 13C - Osterhage, C., Konig, G.M., Holler, U., Wright, A.D. J Nat Prod (2002) 65, 306-13
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Sativanes; 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) | 55.8 |
| 2 (C) | 159.3 |
| 3 (C) | 44 |
| 4 (CH2) | 41.2 |
| 5 (CH2) | 26.8 |
| 6 (CH) | 43.7 |
| 7 (CH) | 43 |
| 8 (CH3) | 21.1 |
| 9 (CH) | 34.3 |
| 10 (CH3) | 21.5 |
| 11 (CH3) | 21.3 |
| 12 (CH2) | 103.3 |
| 13 (CH) | 59.7 |
| 14 (CH) | 76 |
| 15 (CH) | 70 |
