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2,3,4-Pentanetrione, 3-[(2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)hydrazone]
SpectraBase Compound ID JM0lU4mJl5E
InChI InChI=1S/C16H18N4O3/c1-10-14(17-18-15(11(2)21)12(3)22)16(23)20(19(10)4)13-8-6-5-7-9-13/h5-9,17H,1-4H3
InChIKey KEVJMVTUSKUTCR-UHFFFAOYSA-N
Mol Weight 314.35 g/mol
Molecular Formula C16H18N4O3
Exact Mass 314.13789 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID IHZWKuKFEpX
Name 2,3,4-Pentanetrione, 3-[(2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)hydrazone]
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 314.137890453 u
Formula C16H18N4O3
InChI InChI=1S/C16H18N4O3/c1-10-14(17-18-15(11(2)21)12(3)22)16(23)20(19(10)4)13-8-6-5-7-9-13/h5-9,17H,1-4H3
InChIKey KEVJMVTUSKUTCR-UHFFFAOYSA-N
Molecular Weight 314.345 g/mol
SMILES CC(C(C(C)=O)=NNC1=C(C)N(C)N(C2=CC=CC=C2)C1=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.960864