Spektraris NMR
(+)-cis-3β-acetoxybicyclogermacra-1(10)(E),4(E)-diene
Common Name: (+)-cis-3β-acetoxybicyclogermacra-1(10)(E),4(E)-diene
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C17H26O2/c1-11-6-8-14-15(17(14,4)5)10-12(2)16(9-7-11)19-13(3)18/h7,10,14-16H,6,8-9H2,1-5H3/b11-7+,12-10+/t14-,15+,16+/m1/s1
InChIKey: InChIKey=NHDCQMVLIJWKMN-VBOSCFCRSA-N
Formula: C17H26O2
Molecular Weight: 262.38778
Exact Mass: 262.19328
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Wang, Y.M., Harrison, L.J., Tan, B.C. Tetrahedron (2009) 65, 4035-43
Species:
Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Bicyclogermacranes; 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) | 119.8 |
| 2 (CH2) | 30.6 |
| 3 (CH) | 79.1 |
| 4 (C) | 126.1 |
| 5 (CH) | 126.3 |
| 6 (CH) | 26.8 |
| 7 (CH) | 30.3 |
| 8 (CH2) | 27 |
| 9 (CH2) | 37.1 |
| 10 (C) | 143.5 |
| 11 (C) | 20.3 |
| 12 (CH3) | 29.1 |
| 13 (CH3) | 15.4 |
| 14 (CH3) | 21.1 |
| 15 (CH3) | 15.7 |
| 3a (C) | 170.2 |
| 3b (CH3) | 21.3 |
