| SpectraBase Spectrum ID |
6LrEHLAr0lg |
| Name |
(6R,8S,9R)-Isocaryolane-6,8,9-triol |
| Appearance |
Amorphous solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H26O3 |
| InChI |
InChI=1S/C15H26O3/c1-13(2)6-9-12(13)10(16)7-15(18)8-14(9,3)5-4-11(15)17/h9-12,16-18H,4-8H2,1-3H3/t9-,10+,11+,12-,14-,15+/m0/s1 |
| InChIKey |
YQHLSOPZTPZIDZ-OFVCQEMXSA-N |
| Instrument Name |
Finnigan Voyager |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np1009465 |
| Molecular Weight |
254.370 g/mol |
| Optical Rotation |
[R]D25 = +7 (c = 0.41, MeOH) |
| Reported Formula |
C15H26O3 |
| SMILES |
O[C@@]1(CC[C@]2(C[C@@]1(C[C@]([C@@]1([C@@]2(CC1(C)C)[H])[H])(O)[H])O)C)[H] |
| SPLASH |
splash10-052b-3900000000-c58e1c2e2d8c17a40d74 |
| Source of Spectrum |
G4-74-1711-9 |
| Wiley ID |
1849199 |
