| SpectraBase Spectrum ID |
Y5Qa1w4z5R |
| Name |
2-Cyclohexene-1-propanoic acid, 1-(ethoxycarbonyl)-2-methyl-4-oxo- |
| CAS Registry Number |
112905-45-0 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H18O5 |
| InChI |
InChI=1S/C13H18O5/c1-3-18-12(17)13(7-5-11(15)16)6-4-10(14)8-9(13)2/h8H,3-7H2,1-2H3,(H,15,16) |
| InChIKey |
HLXBODIGDPZOBL-UHFFFAOYSA-N |
| Molecular Weight |
254.282 g/mol |
| SMILES |
OC(CCC1(C(=CC(CC1)=O)C)C(=O)OCC)=O |
| SPLASH |
splash10-00fr-9800000000-231fa7e5048f10b5661e |
| Source of Spectrum |
B-40-1339-23 |
| Synonyms |
3-(1'-Ethoxycarbonyl-2'-methyl-4-oxocyclohex-2'-enyl) propanoic acid
3-[1-(ethoxycarbonyl)-2-methyl-4-oxo-2-cyclohexen-1-yl]propanoic acid
Ethyl 1-(2'-carboxyethyl)-2-methyl-4-oxocyclohex-2-ene-1-carboxylate |
| Wiley ID |
1257512 |
