| SpectraBase Spectrum ID |
IHk8CAVhUH7 |
| Name |
3-aza-2-(4-Chlorophenyl)-1,1-dicyano-3-(1-methylpyrrolidin-2-yliden)propene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
284.082874135 u |
| Formula |
C15H13ClN4 |
| InChI |
InChI=1S/C15H13ClN4/c1-20-8-2-3-14(20)19-15(12(9-17)10-18)11-4-6-13(16)7-5-11/h4-7H,2-3,8H2,1H3/b19-14+ |
| InChIKey |
GFEKLTUAKFMHNQ-XMHGGMMESA-N |
| SMILES |
C(\N=C/1CCCN1C)(=C(C#N)C#N)C1=CC=C(C=C1)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.939526 |
