| SpectraBase Spectrum ID |
EtlfMVGGm7m |
| Name |
2-Cyclohexene-1-carboxylic acid, 1-(4-methoxyphenyl)-4-oxo-, ethyl ester |
| Alternate Name(s) |
ethyl 1-(4-methoxyphenyl)-4-oxo-2-cyclohexene-1-carboxylate
Ethyl 1-(p-methoxyphenyl)-4-oxocyclohex-2-enecarboxylate |
| CAS Registry Number |
116059-79-1 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H18O4 |
| InChI |
InChI=1S/C16H18O4/c1-3-20-15(18)16(10-8-13(17)9-11-16)12-4-6-14(19-2)7-5-12/h4-8,10H,3,9,11H2,1-2H3 |
| InChIKey |
XBEWFNBDCSGHQA-UHFFFAOYSA-N |
| Molecular Weight |
274.316 g/mol |
| SMILES |
C1(C=CC(CC1)=O)(C(=O)OCC)c1ccc(cc1)OC |
| SPLASH |
splash10-0udi-0090000000-f40520a2067547625a5f |
| Source of Spectrum |
KC-1987-2693-11 |
| Wiley ID |
1278233 |
