Spektraris NMR
Sativene epoxide
Common Name: Sativene epoxide
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H24O3/c1-7(2)8-4-5-14(3)10-9(8)11(13(17)12(10)16)15(14)6-18-15/h7-13,16-17H,4-6H2,1-3H3/t8-,9+,10-,11+,12-,13+,14-,15+/m1/s1
InChIKey: InChIKey=VHMNAPBFMHCKLZ-JUIPADMUSA-N
Formula: C15H24O3
Molecular Weight: 252.349831
Exact Mass: 252.172545
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) | 52.9 |
| 2 (C) | 68.4 |
| 3 (C) | 39.9 |
| 4 (CH2) | 37.3 |
| 5 (CH2) | 26 |
| 6 (CH) | 43.4 |
| 7 (CH) | 42.5 |
| 8 (CH3) | 19.6 |
| 9 (CH) | 34.5 |
| 10 (CH3) | 21.5 |
| 11 (CH3) | 21.3 |
| 12 (CH2) | 51.1 |
| 13 (CH) | 59.6 |
| 14 (CH) | 69.9 |
| 15 (CH) | 73.2 |
