| SpectraBase Compound ID | 4gXO6ryZtTj |
|---|---|
| InChI | InChI=1S/C9H4N2O/c10-4-7-2-1-3-8(5-11)9(7)6-12/h1-3,6H |
| InChIKey | UYKUDVMGMZDHMR-UHFFFAOYSA-N |
| Mol Weight | 156.14 g/mol |
| Molecular Formula | C9H4N2O |
| Exact Mass | 156.032363 g/mol |
Vapor Phase (Gas) Infrared Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | JUEt4JPbTlR |
|---|---|
| Name | 2,6-Dicyanobenzaldehyde |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 156.032362756 u |
| Formula | C9H4N2O |
| InChI | InChI=1S/C9H4N2O/c10-4-7-2-1-3-8(5-11)9(7)6-12/h1-3,6H |
| InChIKey | UYKUDVMGMZDHMR-UHFFFAOYSA-N |
| Molecular Weight | 156.144 g/mol |
| SMILES | C(#N)C1=C(C(C#N)=CC=C1)C=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.806987 |