| SpectraBase Spectrum ID |
4F7Hp8qgEO0 |
| Name |
(1R,2E,4R,7E,11S,12R)-2,7,18-Dolabellatriene |
| Appearance |
Colorless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H32 |
| InChI |
InChI=1S/C20H32/c1-15(2)18-12-14-20(5)13-11-17(4)8-6-7-16(3)9-10-19(18)20/h7,11,13,17-19H,1,6,8-10,12,14H2,2-5H3/b13-11+,16-7+/t17-,18+,19+,20+/m1/s1 |
| InChIKey |
DQSHCYDPVQKJSC-IAGGUBJBSA-N |
| Instrument Name |
Hewlett-Packard 5973 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np1006586 |
| Molecular Weight |
272.476 g/mol |
| Optical Rotation |
[a]D20 = -21 (c = 0.03, CHCl3) |
| Reported Formula |
C20H32 |
| SMILES |
[C@@]12([C@]([C@@](CC2)(C(=C)C)[H])(CC\C(=C\CC[C@](\C=C\1)(C)[H])C)[H])C |
| SPLASH |
splash10-0a7l-5930000000-4f107be17620193aa11f |
| Source of Spectrum |
G4-74-221-15 |
| Wiley ID |
1849044 |
