Spektraris NMR
221466-41-7
Common Name: 221466-41-7
Synonyms: 221466-41-7
CAS Registry Number:
InChI: InChI=1S/C20H32O2/c1-7-18(4,22)10-11-20(6)14(2)8-9-19(5)15(3)12-16(21)13-17(19)20/h7,12,14,17,22H,1,8-11,13H2,2-6H3/t14-,17+,18+,19+,20+/m1/s1
InChIKey: InChIKey=KARUSPOBGJZEMI-SSRYDLFMSA-N
Formula: C20H32O2
Molecular Weight: 304.467632
Exact Mass: 304.24023
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Bomm, M.D., Zukerman-Schpector, J., Lopes, L.M.X. Phytochemistry (1999) 50, 455-61
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Clerodanes; 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) | 34.3 |
| 2 (C) | 200.5 |
| 3 (CH) | 127.4 |
| 4 (C) | 172.6 |
| 5 (C) | 39.7 |
| 6 (CH2) | 35.5 |
| 7 (CH2) | 26.8 |
| 8 (CH) | 35.8 |
| 9 (C) | 38.3 |
| 10 (CH) | 45.5 |
| 11 (CH2) | 31.1 |
| 12 (CH2) | 34.7 |
| 13 (C) | 73 |
| 14 (CH) | 144.8 |
| 15 (CH2) | 111.9 |
| 16 (CH3) | 27.7 |
| 17 (CH3) | 15.6 |
| 18 (CH3) | 18.9 |
| 19 (CH3) | 18.2 |
| 20 (CH3) | 17.9 |
