| SpectraBase Spectrum ID |
DcG9YTyM7k4 |
| Name |
2-[5-Amino-2-(4-chlorophenyl)-4-cyano-2-(ethylsulfanyl)-2,3-dihydrofuran-3-ylidene]propanedinitrile |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
342.034209863 u |
| Formula |
C16H11ClN4OS |
| InChI |
InChI=1S/C16H11ClN4OS/c1-2-23-16(11-3-5-12(17)6-4-11)14(10(7-18)8-19)13(9-20)15(21)22-16/h3-6H,2,21H2,1H3 |
| InChIKey |
GOIZQWPXUDPYBW-UHFFFAOYSA-N |
| Molecular Weight |
342.804 g/mol |
| SMILES |
C1(C(C(C#N)=C(O1)N)=C(C#N)C#N)(C1=CC=C(C=C1)Cl)SCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.853336 |
![2-[5-Amino-2-(4-chlorophenyl)-4-cyano-2-(ethylsulfanyl)-2,3-dihydrofuran-3-ylidene]propanedinitrile](/api/spectrum/DcG9YTyM7k4/structure.png?h=300&w=458 "2-[5-Amino-2-(4-chlorophenyl)-4-cyano-2-(ethylsulfanyl)-2,3-dihydrofuran-3-ylidene]propanedinitrile")
