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2-{N'-[1-(4-Dimethylamino-phenyl)-meth-(E)-ylidene]-hydrazino}-3-phenyl-3H-quinazolin-4-one
SpectraBase Compound ID JLmKNDsMDT
InChI InChI=1S/C23H21N5O/c1-27(2)18-14-12-17(13-15-18)16-24-26-23-25-21-11-7-6-10-20(21)22(29)28(23)19-8-4-3-5-9-19/h3-16H,1-2H3,(H,25,26)/b24-16+
InChIKey ABJMLCCVOGYIJW-LFVJCYFKSA-N
Mol Weight 383.46 g/mol
Molecular Formula C23H21N5O
Exact Mass 383.17461 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID AIOwUSCvX2j
Name 2-{N'-[1-(4-Dimethylamino-phenyl)-meth-(E)-ylidene]-hydrazino}-3-phenyl-3H-quinazolin-4-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 383.174610315 u
Formula C23H21N5O
InChI InChI=1S/C23H21N5O/c1-27(2)18-14-12-17(13-15-18)16-24-26-23-25-21-11-7-6-10-20(21)22(29)28(23)19-8-4-3-5-9-19/h3-16H,1-2H3,(H,25,26)/b24-16+
InChIKey ABJMLCCVOGYIJW-LFVJCYFKSA-N
Molecular Weight 383.455 g/mol
SMILES C=1(N(C(C2=C(N1)C=CC=C2)=O)C=1C=CC=CC1)N\N=C\C1=CC=C(C=C1)N(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.821829