| SpectraBase Spectrum ID |
3pbwZrVFsSV |
| Name |
2-(2,3-Dichloroinden-1-ylidene)propanedinitrile |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
245.975153537 u |
| Formula |
C12H4Cl2N2 |
| InChI |
InChI=1S/C12H4Cl2N2/c13-11-9-4-2-1-3-8(9)10(12(11)14)7(5-15)6-16/h1-4H |
| InChIKey |
OUWNKQWLOLTVLU-UHFFFAOYSA-N |
| Molecular Weight |
247.084 g/mol |
| SMILES |
C12=CC=CC=C2C(Cl)=C(C1=C(C#N)C#N)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.893292 |
