| SpectraBase Spectrum ID |
F873tozlBNJ |
| Name |
3-(3,5-Dimethyl-4-hydroxyphenyl)-2-(methoxycarbonyl)-2-cyclohexen-1-one |
| Alternate Name(s) |
methyl 2-(4-hydroxy-3,5-dimethylphenyl)-6-oxo-1-cyclohexene-1-carboxylate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H18O4 |
| InChI |
InChI=1S/C16H18O4/c1-9-7-11(8-10(2)15(9)18)12-5-4-6-13(17)14(12)16(19)20-3/h7-8,18H,4-6H2,1-3H3 |
| InChIKey |
PXNCDYYMAUZJJJ-UHFFFAOYSA-N |
| Molecular Weight |
274.316 g/mol |
| SMILES |
Oc1c(cc(C2=C(C(=O)OC)C(=O)CCC2)cc1C)C |
| SPLASH |
splash10-00di-0090000000-7db56760cb6233e1ce72 |
| Source of Spectrum |
J-59-6336-67 |
| Wiley ID |
1278262 |
