| SpectraBase Spectrum ID |
Giu7cORpJTe |
| Name |
1-(2',3'-Dimethoxy-4'-isopropylbenzyl)-3,3-dimethyl-4-oxo-2-[(hydroxycarbonyl)methylene]-cyclohexane |
| Alternate Name(s) |
(2Z)-[6-(4-isopropyl-2,3-dimethoxybenzyl)-2,2-dimethyl-3-oxocyclohexylidene]ethanoic acid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H30O5 |
| InChI |
InChI=1S/C22H30O5/c1-13(2)16-9-7-15(20(26-5)21(16)27-6)11-14-8-10-18(23)22(3,4)17(14)12-19(24)25/h7,9,12-14H,8,10-11H2,1-6H3,(H,24,25)/b17-12- |
| InChIKey |
QBNCUMCCXYBRCX-ATVHPVEESA-N |
| Molecular Weight |
374.477 g/mol |
| SMILES |
OC(\C=C/1C(C(=O)CCC1Cc1c(c(OC)c(cc1)C(C)C)OC)(C)C)=O |
| SPLASH |
splash10-0096-0509000000-25fab5097e4d446ea677 |
| Source of Spectrum |
SK-29-2120-4 |
| Wiley ID |
880625 |
![1-(2',3'-Dimethoxy-4'-isopropylbenzyl)-3,3-dimethyl-4-oxo-2-[(hydroxycarbonyl)methylene]-cyclohexane](/api/spectrum/Giu7cORpJTe/structure.png?h=300&w=458 "1-(2',3'-Dimethoxy-4'-isopropylbenzyl)-3,3-dimethyl-4-oxo-2-[(hydroxycarbonyl)methylene]-cyclohexane")
