Spektraris NMR
Saturol
Common Name: Saturol
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H28O2/c1-4-18(2)8-7-17-19(3)9-5-14-11-22-12-15(14)16(19)6-10-20(17,21)13-18/h4,11-12,16-17,21H,1,5-10,13H2,2-3H3/t16-,17+,18-,19-,20+/m0/s1
InChIKey: InChIKey=SNGSHXQSCZHIPB-LJDSDSDDSA-N
Formula: C20H28O2
Molecular Weight: 300.435869
Exact Mass: 300.20893
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Labbe, C., Castillo, M., Fainia, F., Coll, J., Connolly, J.D. Phytochemistry (1994) 35, 735-8
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Abeo-Isopimaranes; 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) | 35.3 |
| 2 (CH2) | 20.9 |
| 3 (C) | 119.8 |
| 4 (C) | 126.5 |
| 5 (CH) | 43.9 |
| 6 (CH2) | 16.1 |
| 7 (CH2) | 42.1 |
| 8 (C) | 72.8 |
| 9 (CH) | 52.9 |
| 10 (C) | 36.3 |
| 11 (CH2) | 18 |
| 12 (CH2) | 38.3 |
| 13 (C) | 36.6 |
| 14 (CH2) | 52 |
| 15 (CH) | 151.5 |
| 16 (CH2) | 108.7 |
| 17 (CH3) | 24.6 |
| 18 (CH) | 136.3 |
| 19 (CH) | 137.7 |
| 20 (CH3) | 11.8 |
