| SpectraBase Spectrum ID |
DfPaKTw7A1I |
| Name |
Propanedinitrile, 2-(2,5-diethoxybenzylidene)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
242.105527697 u |
| Formula |
C14H14N2O2 |
| InChI |
InChI=1S/C14H14N2O2/c1-3-17-13-5-6-14(18-4-2)12(8-13)7-11(9-15)10-16/h5-8H,3-4H2,1-2H3 |
| InChIKey |
LVIWWBUSTJUWDV-UHFFFAOYSA-N |
| Molecular Weight |
242.278 g/mol |
| SMILES |
C(=CC1=C(C=CC(=C1)OCC)OCC)(C#N)C#N |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.850802 |
