| SpectraBase Spectrum ID |
9DXRNpqLAex |
| Name |
(E)-.beta.-Ethoxy-.alpha.-phenylacrylonitrile |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
173.084063977 u |
| Formula |
C11H11NO |
| InChI |
InChI=1S/C11H11NO/c1-2-13-9-11(8-12)10-6-4-3-5-7-10/h3-7,9H,2H2,1H3/b11-9- |
| InChIKey |
ZFRGVNBJKCAFAF-LUAWRHEFSA-N |
| Molecular Weight |
173.215 g/mol |
| SMILES |
C(\C(=C\OCC)C1=CC=CC=C1)#N |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.856658 |
