| SpectraBase Spectrum ID |
1Ws1ioGhblW |
| Name |
1H-Pyrrole-1-propanoic acid, .alpha.-cyano-.beta.-phenyl-, 1,1-dimethylethyl ester |
| CAS Registry Number |
75391-14-9 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H20N2O2 |
| InChI |
InChI=1S/C18H20N2O2/c1-18(2,3)22-17(21)15(13-19)16(20-11-7-8-12-20)14-9-5-4-6-10-14/h4-12,15-16H,1-3H3 |
| InChIKey |
OWHUOMYAOWVOMA-UHFFFAOYSA-N |
| Molecular Weight |
296.370 g/mol |
| SMILES |
C(C(OC(C)(C)C)=O)(C([n]1cccc1)c1ccccc1)C#N |
| SPLASH |
splash10-0a4m-0690000000-51614b178270d0020569 |
| Source of Spectrum |
K-115-720-0 |
| Synonyms |
tert-Butyl 2-cyano-3-phenyl-3-(1H-pyrrol-1-yl)propanoate
tert-Butyl ester of 2-cyano-3-phenyl-3-(1-pyrrolyl)propionic acid |
| Wiley ID |
1299334 |
