Spektraris NMR
Pseudoplexaural
Common Name: Pseudoplexaural
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H30O2/c1-15-7-5-8-16(2)10-11-18(17(3)14-21)13-19-20(4,22-19)12-6-9-15/h8-9,14,18-19H,3,5-7,10-13H2,1-2,4H3/b15-9+,16-8+/t18-,19-,20+/m0/s1
InChIKey: InChIKey=CECHGFZFJNLAFP-IDCYBSLKSA-N
Formula: C20H30O2
Molecular Weight: 302.45175
Exact Mass: 302.22458
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Rodriguez, A., Acosta, A.L. J Nat Prod (1997) 60, 1134-8
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Cembranes; 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 (CH) | 31.2 |
| 2 (CH2) | 33.7 |
| 3 (CH) | 62.5 |
| 4 (C) | 60.7 |
| 5 (CH2) | 38.3 |
| 6 (CH2) | 23.6 |
| 7 (CH) | 124.9 |
| 8 (C) | 135.1 |
| 9 (CH2) | 39.4 |
| 10 (CH2) | 24.5 |
| 11 (CH) | 123.9 |
| 12 (C) | 133.1 |
| 13 (CH2) | 35.2 |
| 14 (CH2) | 30.3 |
| 15 (C) | 154.5 |
| 16 (CH) | 194.2 |
| 17 (CH2) | 133.5 |
| 18 (CH3) | 16.9 |
| 19 (CH3) | 16.9 |
| 20 (CH3) | 15.7 |
