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1-(4-Nitrophenyl)-3-phenyl-5,6-dihydro-4H-pyridazine
SpectraBase Compound ID iBM2oSk7mI
InChI InChI=1S/C16H15N3O2/c20-19(21)15-10-8-14(9-11-15)18-12-4-7-16(17-18)13-5-2-1-3-6-13/h1-3,5-6,8-11H,4,7,12H2
InChIKey GQYWSMCKIOMLFF-UHFFFAOYSA-N
Mol Weight 281.31 g/mol
Molecular Formula C16H15N3O2
Exact Mass 281.116427 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID BU51KwLMyZJ
Name 1-(4-Nitrophenyl)-3-phenyl-5,6-dihydro-4H-pyridazine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 281.116426733 u
Formula C16H15N3O2
InChI InChI=1S/C16H15N3O2/c20-19(21)15-10-8-14(9-11-15)18-12-4-7-16(17-18)13-5-2-1-3-6-13/h1-3,5-6,8-11H,4,7,12H2
InChIKey GQYWSMCKIOMLFF-UHFFFAOYSA-N
SMILES C1=CC=C(C=C1)C=1CCCN(C2=CC=C(C=C2)N(=O)=O)N1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.961872