Spektraris NMR
ent-3-Oxa-beyer-15-en-2-one
Common Name: ent-3-Oxa-beyer-15-en-2-one
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C19H28O2/c1-16(2)13-6-8-19-10-9-17(3,12-19)7-5-14(19)18(13,4)11-15(20)21-16/h9-10,13-14H,5-8,11-12H2,1-4H3/t13-,14+,17+,18-,19-/m1/s1
InChIKey: InChIKey=LQYWOHZDBYDATA-AUKGUFSJSA-N
Formula: C19H28O2
Molecular Weight: 288.425133
Exact Mass: 288.20893
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Grace, M.H., Faraldos, J.A., Lila, M.A., Coates, R.M. Phytochemistry (2007) 68, 546-53
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Beyeranes; 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) | 44.9 |
| 2 (C) | 171 |
| 4 (C) | 85.9 |
| 5 (CH) | 52.4 |
| 6 (CH2) | 20.1 |
| 7 (CH2) | 36.1 |
| 8 (C) | 48.8 |
| 9 (CH) | 50.1 |
| 10 (C) | 36.7 |
| 11 (CH2) | 22.7 |
| 12 (CH2) | 32.7 |
| 13 (C) | 43.9 |
| 14 (CH2) | 60.8 |
| 15 (CH) | 137.8 |
| 16 (CH) | 133.6 |
| 17 (CH3) | 25.2 |
| 18 (CH3) | 33.2 |
| 19 (CH3) | 24.9 |
| 20 (CH3) | 15.4 |
