Spektraris NMR
Caribenol B
Common Name: Caribenol B
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C19H28O3/c1-10(2)8-13-9-12(4)14-7-6-11(3)15-16(14)19(13,22)18(5,21)17(15)20/h8,11-14,21-22H,6-7,9H2,1-5H3/t11-,12-,13+,14+,18+,19+/m0/s1
InChIKey: InChIKey=UZKZXPWGNRCNCM-NDNLJYSTSA-N
Formula: C19H28O3
Molecular Weight: 304.424538
Exact Mass: 304.203845
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Wei, X., Rodriguez, I.I., Rodriguez, A.D., Barnes, C.L. J Org Chem (2007) 72, 7386-9
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Caribenanes; 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) | 37.7 |
| 2 (CH2) | 37 |
| 3 (CH) | 41.5 |
| 4 (C) | 76.2 |
| 5 (C) | 77.6 |
| 6 (C) | 207.9 |
| 7 (C) | 136.7 |
| 8 (CH) | 28 |
| 9 (CH2) | 31.4 |
| 10 (CH2) | 26.4 |
| 11 (CH) | 41 |
| 12 (C) | 175.3 |
| 13 (CH) | 123.5 |
| 14 (C) | 132.2 |
| 15 (CH3) | 18.4 |
| 16 (CH3) | 26 |
| 17 (CH3) | 19.6 |
| 18 (CH3) | 18.2 |
| 19 (CH3) | 21.5 |
