| SpectraBase Spectrum ID |
B2bk1ljSfCq |
| Name |
(-)-(1R,4R,5S,6R,7S,10R)-Cadinan-1,4,5-triol |
| Appearance |
Colorless needles |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H28O3 |
| InChI |
InChI=1S/C15H28O3/c1-9(2)11-6-5-10(3)15(18)8-7-14(4,17)13(16)12(11)15/h9-13,16-18H,5-8H2,1-4H3/t10-,11+,12-,13+,14-,15-/m1/s1 |
| InChIKey |
NYZINEQQHFXDCC-ARSDKDGVSA-N |
| Instrument Name |
Micromass Autospec-Ultima ETOF |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np040099d |
| Molecular Weight |
256.386 g/mol |
| Optical Rotation |
[a]D20 = -4.0 (c = 0.77, CHCl3) |
| Reported Formula |
C15H28O3 |
| SMILES |
O[C@]1([C@]([C@]2([C@@](CC[C@]([C@@]2(CC1)O)(C)[H])(C(C)C)[H])[H])(O)[H])C |
| SPLASH |
splash10-000i-3920000000-529a9214720ebf1f30f8 |
| Source of Spectrum |
G4-67-1649-6 |
| Wiley ID |
1881550 |
