| SpectraBase Spectrum ID |
6aFDHL1PBPX |
| Name |
(4R,5S)-4,5-bis(bromanyl)-1-[3,5-dimethyl-2,4-bis(oxidanyl)phenyl]hexan-1-one |
| Alternate Name(s) |
(4R,5S)-4,5-dibromo-1-(2,4-dihydroxy-3,5-dimethyl-phenyl)hexan-1-one
(4R,5S)-4,5-dibromo-1-(2,4-dihydroxy-3,5-dimethylphenyl)-1-hexanone |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H18Br2O3 |
| InChI |
InChI=1S/C14H18Br2O3/c1-7-6-10(14(19)8(2)13(7)18)12(17)5-4-11(16)9(3)15/h6,9,11,18-19H,4-5H2,1-3H3/t9-,11+/m0/s1 |
| InChIKey |
JBKSYGBWMCOQNN-GXSJLCMTSA-N |
| Molecular Weight |
394.103 g/mol |
| SMILES |
Oc1c(c(c(cc1C)C(CC[C@]([C@@](Br)(C)[H])(Br)[H])=O)O)C |
| SPLASH |
splash10-014i-0912000000-a98d99f22422c688a628 |
| Source of Spectrum |
F-39-4254-0 |
| Wiley ID |
1365551 |
![(4R,5S)-4,5-bis(bromanyl)-1-[3,5-dimethyl-2,4-bis(oxidanyl)phenyl]hexan-1-one](/api/spectrum/6aFDHL1PBPX/structure.png?h=300&w=458 "(4R,5S)-4,5-bis(bromanyl)-1-[3,5-dimethyl-2,4-bis(oxidanyl)phenyl]hexan-1-one")
