Spektraris NMR
1 lfl,16/~-ether
Common Name: 1 lfl,16/~-ether
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H30O3/c1-17-6-4-7-18(2,16(21)22)14(17)5-8-20-10-12-9-13(15(17)20)23-19(12,3)11-20/h12-15H,4-11H2,1-3H3,(H,21,22)/t12-,13+,14+,15+,17-,18-,19-,20+/m1/s1
InChIKey: InChIKey=NYLTWRHNLDAXLX-SSKYDLQKSA-N
Formula: C20H30O3
Molecular Weight: 318.451155
Exact Mass: 318.219495
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Hanson, J.R., Hitchcock, P.B., Takahashi, J.A. Phytochemistry (1995) 40, 797-800
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Kauranes; 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) | 40.6 |
| 2 (CH2) | 19.6 |
| 3 (CH2) | 38.5 |
| 4 (C) | 43.6 |
| 5 (CH) | 57.4 |
| 6 (CH2) | 22.2 |
| 7 (CH2) | 41.6 |
| 8 (C) | 45.1 |
| 9 (CH) | 58.6 |
| 10 (C) | 37.3 |
| 11 (CH) | 76.8 |
| 12 (CH2) | 38.5 |
| 13 (CH) | 45.9 |
| 14 (CH2) | 43.4 |
| 15 (CH2) | 57.1 |
| 16 (C) | 85.6 |
| 17 (CH3) | 23.5 |
| 18 (CH3) | 29.4 |
| 19 (C) | 180.2 |
| 20 (CH3) | 17.8 |
