(+)-Bisabola-2,10-diene[1,9]oxide

(+)-Bisabola-2,10-diene[1,9]oxide

Common Name: (+)-Bisabola-2,10-diene[1,9]oxide

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C15H24O/c1-10(2)7-13-9-12(4)14-6-5-11(3)8-15(14)16-13/h7-8,12-15H,5-6,9H2,1-4H3/t12-,13+,14-,15-/m0/s1

InChIKey: InChIKey=SUZWJCBHQIOYCF-XGUBFFRZSA-N

Formula: C15H24O1

Molecular Weight: 220.351021

Exact Mass: 220.182715

NMR Solvent: C6D6

MHz:

Calibration:

NMR references: 13C - Warmers, U., Rieck, A., Konig, W.A., Muhle, H. Phytochemistry (1999) 51, 679-82

Species:

Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Bisabolanes; 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 (CH2) 18.01
2 (CH2) 33.06
3 (C) 140.5
4 (CH) 124.46
5 (CH) 75.27
6 (CH) 40.39
7 (CH) 34.9
8 (CH2) 37.78
9 (CH) 76.84
10 (CH) 129.36
11 (C) 134.52
12 (CH3) 27.24
13 (CH3) 19.95
14 (CH3) 20.72
15 (CH3) 25.04