| SpectraBase Spectrum ID |
22bVqlCXCDS |
| Name |
2,6,6-trimethyl-3-oxo-1-cyclohexenecarboxylic acid methyl ester |
| Alternate Name(s) |
3-keto-2,6,6-trimethyl-cyclohexene-1-carboxylic acid methyl ester
methyl 2,6,6-trimethyl-3-oxidanylidene-cyclohexene-1-carboxylate
methyl 2,6,6-trimethyl-3-oxo-cyclohexene-1-carboxylate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H16O3 |
| InChI |
InChI=1S/C11H16O3/c1-7-8(12)5-6-11(2,3)9(7)10(13)14-4/h5-6H2,1-4H3 |
| InChIKey |
IUXFEUOSSQVIFN-UHFFFAOYSA-N |
| Molecular Weight |
196.246 g/mol |
| SMILES |
C1(=C(C(=O)CCC1(C)C)C)C(=O)OC |
| SPLASH |
splash10-0002-0900000000-c336a49e243f19e8f19c |
| Source of Spectrum |
E1-44-46-13 |
| Wiley ID |
1553256 |
