SpectraBase Spectrum ID |
GGVmltbMSs3 |
Name |
4-(2-METHYL-3-OXO-CYCLOHEXYL)BUTYRIC ACID, METHYL ESTER |
Copyright |
Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula |
C12H20O3 |
InChI |
InChI=1S/C12H20O3/c1-9-10(5-3-7-11(9)13)6-4-8-12(14)15-2/h9-10H,3-8H2,1-2H3 |
InChIKey |
XQVJQVBCKBUGIL-UHFFFAOYSA-N |
Molecular Weight |
212.1407 |
SMILES |
C1(=O)C(C)C(CCCC(OC)=O)CCC1 |
SPLASH |
splash10-08fu-9400000000-88b930e5f45ebebbc8c1 |
Source of Spectrum |
Chemical Concepts, A Wiley Division, Weinheim, Germany |