Spektraris NMR
13-Epitorulosal
Common Name: 13-Epitorulosal
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H32O2/c1-6-19(4,22)13-10-16-15(2)8-9-17-18(3,14-21)11-7-12-20(16,17)5/h6,14,16-17,22H,1-2,7-13H2,3-5H3/t16-,17-,18+,19-,20+/m0/s1
InChIKey: InChIKey=GLJXUJMLZHNKJU-UHZRXMQZSA-N
Formula: C20H32O2
Molecular Weight: 304.467632
Exact Mass: 304.24023
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Su, W.C., Fang, J.M., Cheng, Y.S. Phytochemistry (1994) 37, 1109-14
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Labdanes; 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) | 34.4 |
| 2 (CH2) | 19.2 |
| 3 (CH2) | 38.4 |
| 4 (C) | 48.6 |
| 5 (CH) | 55.8 |
| 6 (CH2) | 24 |
| 7 (CH2) | 38.4 |
| 8 (C) | 147.5 |
| 9 (CH) | 55.9 |
| 10 (C) | 40.2 |
| 11 (CH2) | 17.9 |
| 12 (CH2) | 41.3 |
| 13 (C) | 73.6 |
| 14 (CH) | 145 |
| 15 (CH2) | 111.7 |
| 16 (CH3) | 28.1 |
| 17 (CH2) | 107.3 |
| 18 (CH3) | 24.3 |
| 19 (CH) | 205.7 |
| 20 (CH3) | 13.5 |
