Spektraris NMR
SCHEMBL16260938
Common Name: SCHEMBL16260938
Synonyms: SCHEMBL16260938
CAS Registry Number:
InChI: InChI=1S/C20H34O2/c1-15-6-9-18-19(2,3)11-5-12-20(18,4)17(15)8-7-16(14-22)10-13-21/h7,17-18,21-22H,1,5-6,8-14H2,2-4H3/b16-7+/t17-,18-,20+/m0/s1
InChIKey: InChIKey=DDVAZDCKVCUKBI-OQONWLFBSA-N
Formula: C20H34O2
Molecular Weight: 306.483513
Exact Mass: 306.25588
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Zhou, B.N., Baj, N.J., Glass, T.E., Malone, S., Werkhoven, M.C., van Troon, F., David, Wisse, J.H., Kingston, D.G. J Nat Prod (1997) 60, 1287-93
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) | 39.15 |
| 2 (CH2) | 19.35 |
| 3 (CH2) | 42.08 |
| 4 (C) | 33.6 |
| 5 (CH) | 55.4 |
| 6 (CH2) | 24.1 |
| 7 (CH2) | 38.07 |
| 8 (C) | 148.49 |
| 9 (CH) | 57.1 |
| 10 (C) | 39.55 |
| 11 (CH2) | 22.29 |
| 12 (CH) | 132.39 |
| 13 (C) | 135.43 |
| 14 (CH2) | 32.79 |
| 15 (CH2) | 61.5 |
| 16 (CH2) | 68.6 |
| 17 (CH2) | 107.38 |
| 18 (CH3) | 33.6 |
| 19 (CH3) | 21.74 |
| 20 (CH3) | 14.41 |
