Spektraris NMR
Epoxyjhanidiol
Common Name: Epoxyjhanidiol
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H34O4/c1-17(12-21)8-7-15(22)20(4)13(17)5-9-18(2)14(20)6-10-19(3,24-18)16-11-23-16/h13-16,21-22H,5-12H2,1-4H3/t13-,14-,15+,16?,17-,18+,19+,20-/m0/s1
InChIKey: InChIKey=VFXIGNNFAYBQMM-YFMOEBLASA-N
Formula: C20H34O4
Molecular Weight: 338.482323
Exact Mass: 338.24571
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Fraga, B.M., Gonzalez, P., Guillermo, R., Hernandez, M.G. J Nat Prod (1998) 61, 1237-41
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 (CH) | 79.3 |
| 2 (CH2) | 29.1 |
| 3 (CH2) | 33.1 |
| 4 (C) | 37.3 |
| 5 (CH) | 48.1 |
| 6 (CH2) | 19.5 |
| 7 (CH2) | 42.4 |
| 8 (C) | 65 |
| 9 (CH) | 58 |
| 10 (C) | 42.6 |
| 11 (CH2) | 17.7 |
| 12 (CH2) | 33.4 |
| 13 (C) | 70.9 |
| 14 (CH) | 59.9 |
| 15 (CH2) | 43.9 |
| 16 (CH3) | 24.8 |
| 17 (CH3) | 24.2 |
| 18 (CH2) | 71.4 |
| 19 (CH3) | 16.8 |
| 20 (CH3) | 11.9 |
