Spektraris NMR
6-Oxo-ferruginol
Common Name: 6-Oxo-ferruginol
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H28O2/c1-12(2)14-9-13-10-17(22)18-19(3,4)7-6-8-20(18,5)15(13)11-16(14)21/h9,11-12,18,21H,6-8,10H2,1-5H3/t18?,20-/m1/s1
InChIKey: InChIKey=BGVCOQAMEPLESK-ROPPNANJSA-N
Formula: C20H28O2
Molecular Weight: 300.435869
Exact Mass: 300.20893
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Ulubelen, A., Topcu, G., Sonmez, U., Choudhary, M.I., Attaurrahman. Phytochemistry (1995) 40, 861-4
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Abietanes; 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) | 35.4 |
| 2 (CH2) | 18.7 |
| 3 (CH2) | 41.9 |
| 4 (C) | 32.2 |
| 5 (CH) | 58 |
| 6 (C) | 207.2 |
| 7 (CH2) | 42.5 |
| 8 (C) | 135.8 |
| 9 (C) | 149.3 |
| 10 (C) | 41.4 |
| 11 (CH) | 118.9 |
| 12 (C) | 151.2 |
| 13 (C) | 132.8 |
| 14 (CH) | 126.5 |
| 15 (CH) | 26.7 |
| 16 (CH3) | 21.6 |
| 17 (CH3) | 21.1 |
| 18 (CH3) | 32.3 |
| 19 (CH3) | 22.8 |
| 20 (CH3) | 22.5 |
