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4-(2-Nitrophenyl)-8-phenyl-1,3,4,6-tetrahydropyrido[2,3-D]pyridazine-2,5-dione
SpectraBase Compound ID FjlRS8LjSSC
InChI InChI=1S/C19H14N4O4/c24-15-10-13(12-8-4-5-9-14(12)23(26)27)16-18(20-15)17(21-22-19(16)25)11-6-2-1-3-7-11/h1-9,13H,10H2,(H,20,24)(H,22,25)
InChIKey QWSBYVXNUUJPQN-UHFFFAOYSA-N
Mol Weight 362.35 g/mol
Molecular Formula C19H14N4O4
Exact Mass 362.101505 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID E3Vyezj0vat
Name 4-(2-Nitrophenyl)-8-phenyl-1,3,4,6-tetrahydropyrido[2,3-D]pyridazine-2,5-dione
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 362.101504943 u
Formula C19H14N4O4
InChI InChI=1S/C19H14N4O4/c24-15-10-13(12-8-4-5-9-14(12)23(26)27)16-18(20-15)17(21-22-19(16)25)11-6-2-1-3-7-11/h1-9,13H,10H2,(H,20,24)(H,22,25)
InChIKey QWSBYVXNUUJPQN-UHFFFAOYSA-N
Molecular Weight 362.345 g/mol
SMILES C12=C(C(C3=CC=CC=C3)=NNC1=O)NC(CC2C=1C(N(=O)=O)=CC=CC1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.933012