| SpectraBase Spectrum ID |
3Ldv6oQbZJS |
| Name |
Cyclohexanepropanoic acid, 1,4,4-trimethyl-2-oxo-, methyl ester |
| CAS Registry Number |
54699-30-8 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H22O3 |
| InChI |
InChI=1S/C13H22O3/c1-12(2)7-8-13(3,10(14)9-12)6-5-11(15)16-4/h5-9H2,1-4H3 |
| InChIKey |
FROIYKFPVJACQR-UHFFFAOYSA-N |
| Molecular Weight |
226.316 g/mol |
| SMILES |
C(CC1(C)C(=O)CC(CC1)(C)C)C(OC)=O |
| SPLASH |
splash10-0536-9300000000-fd56833ead973c3c03f2 |
| Source of Spectrum |
SD-1981-0-0 |
| Synonyms |
Methyl 3-(1,4,4-trimethyl-2-oxocyclohexyl)propanoate
3-(1,4,4-trimethyl-2-oxocyclohexyl)propanoic acid methyl ester
3-(2-keto-1,4,4-trimethyl-cyclohexyl)propionic acid methyl ester
Methyl 3-(1,4,4-trimethyl-2-oxidanylidene-cyclohexyl)propanoate |
| Wiley ID |
1227538 |
