Spektraris NMR
130395-82-3
Common Name: 130395-82-3
Synonyms: 130395-82-3
CAS Registry Number:
InChI: InChI=1S/C20H32O2/c1-14(8-11-21)6-9-19(4)15(2)7-10-20(5)16(3)12-17(22)13-18(19)20/h8,12,15,18,21H,6-7,9-11,13H2,1-5H3/b14-8+/t15-,18-,19+,20+/m1/s1
InChIKey: InChIKey=FZJNCAOKSWDFOY-SJRDTMCLSA-N
Formula: C20H32O2
Molecular Weight: 304.467632
Exact Mass: 304.24023
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Yang, S.M., Wu, S.H., Qin, X.D., Luo, X.D., Wu, D.G. Helv Chim Acta (2004) 87, 1279-86
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) | 35 |
| 2 (C) | 200.5 |
| 3 (CH) | 125.4 |
| 4 (C) | 172.7 |
| 5 (C) | 39.8 |
| 6 (CH2) | 35.7 |
| 7 (CH2) | 26.8 |
| 8 (CH) | 35.9 |
| 9 (C) | 38.6 |
| 10 (CH) | 45.6 |
| 11 (CH2) | 35.5 |
| 12 (CH2) | 32.2 |
| 13 (C) | 139.7 |
| 14 (CH) | 123.3 |
| 15 (CH2) | 59.3 |
| 16 (CH3) | 16.6 |
| 17 (CH3) | 15.7 |
| 18 (CH3) | 19 |
| 19 (CH3) | 18.3 |
| 20 (CH3) | 17.9 |
