SpectraBase Spectrum ID |
3nmC7ACHwfL |
Name |
3-Methyl-4-p-tolylhydrazono-2-pyrazolin-5-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
216.101111021 u |
Formula |
C11H12N4O |
InChI |
InChI=1S/C11H12N4O/c1-7-3-5-9(6-4-7)13-14-10-8(2)12-15-11(10)16/h3-6,13H,1-2H3,(H,14,15,16) |
InChIKey |
WCICUKIGRVGDHU-UHFFFAOYSA-N |
Molecular Weight |
216.244 g/mol |
SMILES |
C1(=NNC(\C1=N\NC1=CC=C(C=C1)C)=O)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.91318 |