Spektraris NMR
Epoxyxeniaphyllandiol
Common Name: Epoxyxeniaphyllandiol
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H34O3/c1-13-6-7-17-20(5,23-17)11-8-15-14(13)12-19(15,4)10-9-16(21)18(2,3)22/h14-17,21-22H,1,6-12H2,2-5H3/t14-,15+,16?,17-,19+,20+/m0/s1
InChIKey: InChIKey=OYDLDNUNZZRDAY-QJLBAZFMSA-N
Formula: C20H34O3
Molecular Weight: 322.482918
Exact Mass: 322.250795
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Groweiss, A., Kashman, Y. Tetrahedron (1983) 39, 3385
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Xeniaphyllanes; 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) | 50 |
| 2 (CH2) | 27.9 |
| 3 (CH2) | 39.1 |
| 4 (C) | 59.9 |
| 5 (CH) | 63.9 |
| 6 (CH2) | 30.2 |
| 7 (CH2) | 29.8 |
| 8 (C) | 151.8 |
| 9 (CH) | 48.7 |
| 10 (CH2) | 38.4 |
| 11 (C) | 37 |
| 12 (CH2) | 41.2 |
| 13 (CH2) | 25.9 |
| 14 (CH) | 79.2 |
| 15 (C) | 73.2 |
| 16 (CH3) | 26.7 |
| 17 (CH3) | 23.3 |
| 18 (CH3) | 19 |
| 19 (CH2) | 113.1 |
| 20 (CH3) | 17.1 |
