| SpectraBase Spectrum ID |
DXYYJOplt4k |
| Name |
2-Cyclohexene-1-carboxylic acid, 1-(4-methoxyphenyl)-3-methyl-4-oxo-, ethyl ester |
| CAS Registry Number |
116059-82-6 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H20O4 |
| InChI |
InChI=1S/C17H20O4/c1-4-21-16(19)17(10-9-15(18)12(2)11-17)13-5-7-14(20-3)8-6-13/h5-8,11H,4,9-10H2,1-3H3 |
| InChIKey |
KPNJYTGCDHZZGH-UHFFFAOYSA-N |
| Molecular Weight |
288.343 g/mol |
| SMILES |
C1(C=C(C)C(CC1)=O)(C(=O)OCC)c1ccc(cc1)OC |
| SPLASH |
splash10-014i-0090000000-54f53e6dd2d5040464c8 |
| Source of Spectrum |
KC-1987-2693-17 |
| Synonyms |
ethyl 1-(4-methoxyphenyl)-3-methyl-4-oxo-2-cyclohexene-1-carboxylate
Ethyl(1-p-methoxyphenyl)-3-methyl-4-oxocyclohex-2-enecarboxylate |
| Wiley ID |
1291830 |
