| SpectraBase Spectrum ID |
KY61a4yrDZa |
| Name |
Benzeneacetonitrile, .alpha.-[[5-(4-nitrophenyl)-2-furanyl]methylene]- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
316.084792251 u |
| Formula |
C19H12N2O3 |
| InChI |
InChI=1S/C19H12N2O3/c20-13-16(14-4-2-1-3-5-14)12-18-10-11-19(24-18)15-6-8-17(9-7-15)21(22)23/h1-12H/b16-12+ |
| InChIKey |
FTIRALXFEHSHDR-FOWTUZBSSA-N |
| Molecular Weight |
316.316 g/mol |
| SMILES |
C=1C=CC(\C(=C\C=2OC(C=3C=CC(N(=O)=O)=CC3)=CC2)C#N)=CC1 |