| SpectraBase Spectrum ID |
1FKEQ1pVHlx |
| Name |
(2R,3S,4R,6R)-2,3,4-trihydroxy-3-methyl-6-(5-methyl-1-methylene-hex-4-enyl)cyclohexanone |
| Appearance |
clear oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H24O4 |
| InChI |
InChI=1S/C15H24O4/c1-9(2)6-5-7-10(3)11-8-12(16)15(4,19)14(18)13(11)17/h6,11-12,14,16,18-19H,3,5,7-8H2,1-2,4H3/t11-,12-,14+,15+/m1/s1 |
| InChIKey |
QDYJJDBZEHVSMQ-UXOAXIEHSA-N |
| Instrument Name |
Montana State |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np049975d |
| Molecular Weight |
268.353 g/mol |
| Optical Rotation |
[a]D20 = +5.5 (c = 0.011, MeOH) |
| Reported Formula |
C15H24O4 |
| SMILES |
O[C@]1(C([C@](C[C@]([C@]1(C)O)(O)[H])(C(=C)CCC=C(C)C)[H])=O)[H] |
| SPLASH |
splash10-014i-9400000000-84c83229adec47e8ef8e |
| Source of Spectrum |
G4-67-1394-1 |
| Wiley ID |
1881855 |
