Spektraris NMR
Peroxypolasol
Common Name: Peroxypolasol
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H34O3/c1-14-6-7-15-16(9-12-19(15,4)11-8-14)20(5)13-10-17(22-23-20)18(2,3)21/h8,15-17,21H,6-7,9-13H2,1-5H3/t15-,16+,17?,19-,20?/m1/s1
InChIKey: InChIKey=GUTACGWTNMGUKI-ABVNKWNHSA-N
Formula: C20H34O3
Molecular Weight: 322.482918
Exact Mass: 322.250795
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Umeyama, A., Machida, M., Nozaki, M., Arihara, S. J Nat Prod (1998) 61, 1435-6
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Sphenolobanes; 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) | 26.2 |
| 2 (CH2) | 34.4 |
| 3 (C) | 138.9 |
| 4 (CH) | 122.4 |
| 5 (CH2) | 41.1 |
| 6 (C) | 42.7 |
| 7 (CH2) | 41.2 |
| 8 (CH2) | 25.3 |
| 9 (CH) | 51.8 |
| 10 (CH) | 55.2 |
| 11 (CH3) | 27.2 |
| 12 (CH3) | 18.7 |
| 13 (C) | 86.6 |
| 14 (CH3) | 24.2 |
| 15 (CH2) | 34.7 |
| 16 (CH2) | 26 |
| 17 (CH) | 83.1 |
| 18 (C) | 71.5 |
| 19 (CH3) | 24.3 |
| 20 (CH3) | 27.4 |
