| SpectraBase Spectrum ID |
LUoRaFLQxqD |
| Name |
(1S,2R,5R)-5-(2-Hydroxypropan-2-yl)-2-methylcyclohex-3-ene-1,2-diol |
| Appearance |
Colorless syrup |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C10H18O3 |
| InChI |
InChI=1S/C10H18O3/c1-9(2,12)7-4-5-10(3,13)8(11)6-7/h4-5,7-8,11-13H,6H2,1-3H3/t7-,8-,10+/m0/s1 |
| InChIKey |
OOJRSSYEQZCXGT-OYNCUSHFSA-N |
| Instrument Name |
Micromass Autospec |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/acs.jnatprod.5b00501 |
| Molecular Weight |
186.251 g/mol |
| Optical Rotation |
[a]D = -15.7 (c = 0.28, CHCl3) |
| Reported Formula |
C10H18O3 |
| SMILES |
OC([C@@]1(C[C@@]([C@@](C=C1)(O)C)(O)[H])[H])(C)C |
| SPLASH |
splash10-0bt9-9600000000-d0705a9ffe9f6c4ca186 |
| Source of Spectrum |
G4-79-265-8 |
| Wiley ID |
1849251 |
