| SpectraBase Spectrum ID |
BsC3GJOysS4 |
| Name |
3-(5-Cyano-2-methoxy-phenyl)-4-methoxy-benzenecarbonitrile |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
264.089877632 u |
| Formula |
C16H12N2O2 |
| InChI |
InChI=1S/C16H12N2O2/c1-19-15-5-3-11(9-17)7-13(15)14-8-12(10-18)4-6-16(14)20-2/h3-8H,1-2H3 |
| InChIKey |
MKRZYYIDLOZXCS-UHFFFAOYSA-N |
| Molecular Weight |
264.284 g/mol |
| SMILES |
C=1(C(=CC=C(C1)C#N)OC)C=1C(=CC=C(C1)C#N)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.903818 |
