| SpectraBase Spectrum ID |
TCEtQOQ4W |
| Name |
Ethyl 1-(2'-cyanoethyl)-3-oxocycloheptane-1-carboxylate |
| Alternate Name(s) |
Ethyl 1-(2-cyanoethyl)-3-oxocycloheptanecarboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H19NO3 |
| InChI |
InChI=1S/C13H19NO3/c1-2-17-12(16)13(8-5-9-14)7-4-3-6-11(15)10-13/h2-8,10H2,1H3 |
| InChIKey |
WJBFHXAWPNYGMK-UHFFFAOYSA-N |
| Molecular Weight |
237.299 g/mol |
| SMILES |
C1(C(=O)OCC)(CC(=O)CCCC1)CCC#N |
| SPLASH |
splash10-0bt9-6900000000-afdf6c960e523c0c7a66 |
| Source of Spectrum |
Y5-59-941-13 |
| Wiley ID |
879313 |
