SpectraBase Spectrum ID |
8Quwk4iDPdk |
Name |
1-Phenyl-3-(2-nitrophenyl)-2-pyrazoline |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
267.100776669 u |
Formula |
C15H13N3O2 |
InChI |
InChI=1S/C15H13N3O2/c19-18(20)15-9-5-4-8-13(15)14-10-11-17(16-14)12-6-2-1-3-7-12/h1-9H,10-11H2 |
InChIKey |
YWNGYHIQQHWFJD-UHFFFAOYSA-N |
Molecular Weight |
267.288 g/mol |
SMILES |
C=1(CCN(N1)C1=CC=CC=C1)C1=CC=CC=C1N(=O)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.863701 |