| SpectraBase Spectrum ID |
nr6ryeZ2JO |
| Name |
(Z)-3-Nitro-alpha-(p-nitrophenyl)cinnamic acid |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
314.053886044 u |
| Formula |
C15H10N2O6 |
| InChI |
InChI=1S/C15H10N2O6/c18-15(19)14(11-4-6-12(7-5-11)16(20)21)9-10-2-1-3-13(8-10)17(22)23/h1-9H,(H,18,19)/b14-9+ |
| InChIKey |
AYZYEGDGQIHOST-NTEUORMPSA-N |
| Molecular Weight |
314.253 g/mol |
| SMILES |
C1(\C=C\(C(=O)O)C2=CC=C(C=C2)N(=O)=O)=CC(=CC=C1)N(=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.962725 |
