SpectraBase Spectrum ID |
L4VjAks6hhe |
Name |
Anti-5-methyl-2-aminobenzophenone 4-phenylsemicarbazone |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
344.163711279 u |
Formula |
C21H20N4O |
InChI |
InChI=1S/C21H20N4O/c1-15-12-13-19(22)18(14-15)20(16-8-4-2-5-9-16)24-25-21(26)23-17-10-6-3-7-11-17/h2-14H,22H2,1H3,(H2,23,25,26)/b24-20+ |
InChIKey |
OPFQYWWEBXCSHE-HIXSDJFHSA-N |
Molecular Weight |
344.418 g/mol |
SMILES |
C1(=C(C=CC(=C1)C)N)\C(=N\NC(NC1=CC=CC=C1)=O)C1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.887372 |