| SpectraBase Spectrum ID |
KEvNR5GfXmn |
| Name |
N'-(4-Cyano-2-iodo-6-nitrophenyl)-N,N-dimethylimidoformamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
343.977020544 u |
| Formula |
C10H9IN4O2 |
| InChI |
InChI=1S/C10H9IN4O2/c1-14(2)6-13-10-8(11)3-7(5-12)4-9(10)15(16)17/h3-4,6H,1-2H3/b13-6+ |
| InChIKey |
VXUJVDMDZQDHBY-AWNIVKPZSA-N |
| Molecular Weight |
344.112 g/mol |
| SMILES |
C1(N(=O)=O)=C(\N=C\N(C)C)C(I)=CC(C#N)=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.895183 |
