Spektraris NMR
(+)-8,9-Epoxyselina-4,11-diene
Common Name: (+)-8,9-Epoxyselina-4,11-diene
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C15H22O/c1-9(2)11-8-12-10(3)6-5-7-15(12,4)14-13(11)16-14/h11,13-14H,1,5-8H2,2-4H3/t11-,13+,14+,15+/m0/s1
InChIKey: InChIKey=HPCVOEQSOLQFPZ-ZGKBOVNRSA-N
Formula: C15H22O1
Molecular Weight: 218.33514
Exact Mass: 218.167065
NMR Solvent: C6D6
MHz:
Calibration:
NMR references: 13C - Adio, A.M., Paul, C., Konig, W.A., Muhle, H. Phytochemistry (2002) 61, 79-91
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 (CH2) | 35.8 |
| 2 (CH2) | 19 |
| 3 (CH2) | 32.1 |
| 4 (C) | 124.5 |
| 5 (C) | 133.4 |
| 6 (CH2) | 25.4 |
| 7 (CH) | 46.4 |
| 8 (CH) | 56.8 |
| 9 (CH) | 60.6 |
| 10 (C) | 33.5 |
| 11 (C) | 148 |
| 12 (CH2) | 111.4 |
| 13 (CH3) | 21.2 |
| 14 (CH3) | 22.5 |
| 15 (CH3) | 18.4 |
