SpectraBase Spectrum ID |
4AZMl1F9KrZ |
Name |
(1S,6R,7S)-2,10-Bisaboladien-1-ol |
Carrier Gas |
Helium |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C15H26O |
GC Oven Program |
Oven temp 270oC, Splitless or cool-on-column injector |
InChI |
InChI=1S/C15H26O/c1-11(2)6-5-7-13(4)14-9-8-12(3)10-15(14)16/h6,10,13-16H,5,7-9H2,1-4H3/t13-,14+,15+/m0/s1 |
InChIKey |
ZOYAMQNIYAMHTE-RRFJBIMHSA-N |
Instrument Name |
Agilent Technologies 6890N-5973 |
Ionization Type |
EI |
Literature Reference DOI |
10.1021/acs.jnatprod.0c00517 |
Molecular Weight |
222.372 g/mol |
Optical Rotation |
[a]D20 = -157 (c = 1.08, CHCl3) |
SMILES |
O[C@@]1(C=C(CC[C@@]1([C@](CCC=C(C)C)(C)[H])[H])C)[H] |
SPLASH |
splash10-00kf-9700000000-5f64fb48dbe4299c9f96 |
Source of Spectrum |
G4-83-2286-13 |
Wiley ID |
1876899 |