Spektraris NMR
1b,4a-oxi-6b-acetoxyeudesmanes
Common Name: 1b,4a-oxi-6b-acetoxyeudesmanes
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C17H28O3/c1-10(2)12-6-8-16(4)13-7-9-17(5,20-13)15(16)14(12)19-11(3)18/h10,12-15H,6-9H2,1-5H3/t12-,13+,14+,15+,16-,17-/m0/s1
InChIKey: InChIKey=QNAYPSWDMNXHOU-MDOLAMBHSA-N
Formula: C17H28O3
Molecular Weight: 280.403066
Exact Mass: 280.203845
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Cabrera, E., Garcia Granados, A., Aranzazu Quecuty, M. Phytochemistry (1988) 27, 183-5
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Eudesmanes; 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) | 84.9 |
| 2 (CH2) | 23.5 |
| 3 (CH2) | 42.8 |
| 4 (C) | 82.6 |
| 5 (CH) | 57.1 |
| 6 (CH) | 69.6 |
| 7 (CH) | 49.9 |
| 8 (CH2) | 23.2 |
| 9 (CH2) | 33.1 |
| 10 (C) | 48.4 |
| 11 (CH) | 29.4 |
| 12 (CH3) | 20.8 |
| 13 (CH3) | 21.5 |
| 14 (CH3) | 17.5 |
| 15 (CH3) | 22.3 |
| 6a (C) | 170.7 |
| 6b (CH3) | 21.8 |
