| SpectraBase Spectrum ID |
Aj4hyWsjED9 |
| Name |
4-Amino-5-[2-phenylethenyl]benzene-1,2-dicarbonitrile |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
245.095297366 u |
| Formula |
C16H11N3 |
| InChI |
InChI=1S/C16H11N3/c17-10-14-8-13(16(19)9-15(14)11-18)7-6-12-4-2-1-3-5-12/h1-9H,19H2/b7-6+ |
| InChIKey |
URZFYIVYNHFMEK-VOTSOKGWSA-N |
| Molecular Weight |
245.285 g/mol |
| SMILES |
C1(=CC(\C=C\C=2C=CC=CC2)=C(C=C1C#N)N)C#N |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.840655 |
![4-Amino-5-[2-phenylethenyl]benzene-1,2-dicarbonitrile](/api/spectrum/Aj4hyWsjED9/structure.png?h=300&w=458 "4-Amino-5-[2-phenylethenyl]benzene-1,2-dicarbonitrile")
