Spektraris NMR
2a-Hydroxy-teideadiol
Common Name: 2a-Hydroxy-teideadiol
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C20H30O3/c1-12(2)13-5-7-15-14(9-13)6-8-17-19(3,11-21)10-16(22)18(23)20(15,17)4/h5,7,9,12,16-18,21-23H,6,8,10-11H2,1-4H3/t16-,17-,18-,19-,20+/m0/s1
InChIKey: InChIKey=LVVBGHVZOMPBGG-VYJAJWGXSA-N
Formula: C20H30O3
Molecular Weight: 318.451155
Exact Mass: 318.219495
NMR Solvent: CD3OD
MHz:
Calibration:
NMR references: 13C - Fraga, B.M., Hernandez, M.G., Artega, J.M., Suarez, S. Phytochemistry (2003) 63, 663-8
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Abietanes; 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) | 76 |
| 2 (CH) | 67.6 |
| 3 (CH2) | 37.8 |
| 4 (C) | 39.6 |
| 5 (CH) | 38.3 |
| 6 (CH2) | 19.7 |
| 7 (CH2) | 31.6 |
| 8 (C) | 137.2 |
| 9 (C) | 146.8 |
| 10 (C) | 45.2 |
| 11 (CH) | 126.6 |
| 12 (CH) | 124.9 |
| 13 (C) | 144.3 |
| 14 (CH) | 128.1 |
| 15 (CH) | 34.9 |
| 16 (CH3) | 24.5 |
| 17 (CH3) | 24.5 |
| 18 (CH2) | 72.3 |
| 19 (CH3) | 18.7 |
| 20 (CH3) | 28.3 |
