| SpectraBase Spectrum ID |
3movHGjO4Lu |
| Name |
2-[.alpha.-(2-Hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)-3-nitrobenzyl]-5,5-dimethyl-1,3-cyclohexanedione |
| CAS Registry Number |
316132-41-9 |
| Comments |
Structure changed after expert review |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H27NO6 |
| InChI |
InChI=1S/C23H27NO6/c1-22(2)9-15(25)20(16(26)10-22)19(13-6-5-7-14(8-13)24(29)30)21-17(27)11-23(3,4)12-18(21)28/h5-8,19-20,27H,9-12H2,1-4H3 |
| InChIKey |
CFBWCJXUJAXVIT-UHFFFAOYSA-N |
| Molecular Weight |
413.470 g/mol |
| SMILES |
OC1=C(C(c2cccc([N+]([O-])=O)c2)C2C(CC(CC2=O)(C)C)=O)C(CC(C1)(C)C)=O |
| SPLASH |
splash10-0a59-9310000000-9714deb289d7550b44d8 |
| Synonyms |
2-[(2-Hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)(3-nitrophenyl)methyl]-5,5-dimethyl-1,3-cyclohexanedione
2-[(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)(3-nitrophenyl)methyl]-5,5-dimethylcyclohexane-1,3-dione
2-[(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)-(3-nitrophenyl)methyl]-5,5-dimethylcyclohexane-1,3-dione
2-[(6-hydroxy-4,4-dimethyl-2-oxocyclohex-1(6)-enyl)(3-nitrophenyl)methyl]-5,5- dimethylcyclohexane-1,3-dione |
| Wiley ID |
1468702 |
![2-[.alpha.-(2-Hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)-3-nitrobenzyl]-5,5-dimethyl-1,3-cyclohexanedione](/api/spectrum/3movHGjO4Lu/structure.png?h=300&w=458 "2-[.alpha.-(2-Hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)-3-nitrobenzyl]-5,5-dimethyl-1,3-cyclohexanedione")
