| SpectraBase Spectrum ID |
3Ydw4VhVwuY |
| Name |
(3S,8R,9R)-Isocaryolane-3,8,9-triol |
| Appearance |
Yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H26O3 |
| InChI |
InChI=1S/C15H26O3/c1-13(2)9-4-7-15(18)8-14(3,6-5-10(15)16)11(9)12(13)17/h9-12,16-18H,4-8H2,1-3H3/t9-,10-,11-,12+,14+,15-/m1/s1 |
| InChIKey |
LEKIRSOKQLMRGB-PWDJSDCWSA-N |
| Instrument Name |
Finnigan Voyager |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np1009465 |
| Molecular Weight |
254.370 g/mol |
| Optical Rotation |
[a]D25 = -11 (c = 0.33, CHCl3) |
| Reported Formula |
C15H26O3 |
| SMILES |
O[C@@]1(CC[C@]2(C[C@@]1(CC[C@@]1([C@@]2([C@@](C1(C)C)(O)[H])[H])[H])O)C)[H] |
| SPLASH |
splash10-0awd-9610000000-63e59d03cb203b2d9cee |
| Source of Spectrum |
G4-74-1711-8 |
| Wiley ID |
1849198 |
