Spektraris NMR
(?)-2-Acetoxyamorpha-4,7(11)-diene
Common Name: (?)-2-Acetoxyamorpha-4,7(11)-diene
Synonyms: (?)-2-Acetoxyamorpha-4,7(11)-diene
CAS Registry Number:
InChI: InChI=1S/C17H26O2/c1-10(2)14-7-6-12(4)17-15(14)8-11(3)9-16(17)19-13(5)18/h8,12,15-17H,6-7,9H2,1-5H3/t12-,15-,16-,17+/m0/s1
InChIKey: InChIKey=CWMAZHJECLOCQL-OSMBCOQSSA-N
Formula: C17H26O2
Molecular Weight: 262.38778
Exact Mass: 262.19328
NMR Solvent: C6D6
MHz:
Calibration:
NMR references: 13C - Adio, A.M., Paul, C., Konig, W.A., Muhle, H. Phytochemistry (2002) 61, 79-91
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Amorphanes; 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) | 45 |
| 2 (CH) | 75.1 |
| 3 (CH2) | 32.5 |
| 4 (C) | 132.2 |
| 5 (CH) | 126.2 |
| 6 (CH) | 40.9 |
| 7 (C) | 133.5 |
| 8 (CH2) | 26.6 |
| 9 (CH2) | 36.7 |
| 10 (CH) | 28.1 |
| 11 (C) | 122 |
| 12 (CH3) | 19.9 |
| 13 (CH3) | 20.3 |
| 14 (CH3) | 22.8 |
| 15 (CH3) | 21.7 |
| 2a (C) | 169.9 |
| 2b (CH3) | 21.1 |
