| SpectraBase Spectrum ID |
HwKGx5ptTuT |
| Name |
Acetoacetic acid, 1-isopropylcyclohexyl ester |
| Alternate Name(s) |
1-Isopropylcyclohexyl acetoacetate
1-Isopropylcyclohexyl 3-oxobutanoate |
| CAS Registry Number |
15780-57-1 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H22O3 |
| InChI |
InChI=1S/C13H22O3/c1-10(2)13(7-5-4-6-8-13)16-12(15)9-11(3)14/h10H,4-9H2,1-3H3 |
| InChIKey |
PPYGBYNQVWYCML-UHFFFAOYSA-N |
| Molecular Weight |
226.316 g/mol |
| SMILES |
C(OC1(C(C)C)CCCCC1)(CC(=O)C)=O |
| SPLASH |
splash10-0006-9000000000-77de74b4d2605d0ea9f7 |
| Source of Spectrum |
AA-0-1608-3 |
| Wiley ID |
29976 |
