| SpectraBase Spectrum ID |
GKDcUEsMAwF |
| Name |
methyl 2-(2-cyano-3-ethoxy-3-oxopropyl)benzoate |
| Alternate Name(s) |
2-(2-cyano-3-ethoxy-3-oxopropyl)benzoic acid methyl ester
methyl 2-(2-cyano-3-ethoxy-3-oxo-propyl)benzoate
methyl 2-(2-cyano-3-ethoxy-3-oxidanylidene-propyl)benzoate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H15NO4 |
| InChI |
InChI=1S/C14H15NO4/c1-3-19-13(16)11(9-15)8-10-6-4-5-7-12(10)14(17)18-2/h4-7,11H,3,8H2,1-2H3 |
| InChIKey |
SUZBHVXGTJUXSX-UHFFFAOYSA-N |
| Molecular Weight |
261.277 g/mol |
| SMILES |
C(C(=O)OCC)(C#N)Cc1c(C(=O)OC)cccc1 |
| SPLASH |
splash10-0a4i-0900000000-8ff6b269468f1f926a16 |
| Source of Spectrum |
D8-326-861-3 |
| Wiley ID |
1514907 |
