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(E)-2-[4-(Dimethylamino)-styryl]-quinazolin-4(3H)-one
SpectraBase Compound ID 76a3Ht1tAfJ
InChI InChI=1S/C18H17N3O/c1-21(2)14-10-7-13(8-11-14)9-12-17-19-16-6-4-3-5-15(16)18(22)20-17/h3-12H,1-2H3,(H,19,20,22)/b12-9+
InChIKey XCOGSWJYLKIUIA-FMIVXFBMSA-N
Mol Weight 291.35 g/mol
Molecular Formula C18H17N3O
Exact Mass 291.137162 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2eQHrL2MQ3v
Name (E)-2-[4-(Dimethylamino)-styryl]-quinazolin-4(3H)-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 291.137162178 u
Formula C18H17N3O
InChI InChI=1S/C18H17N3O/c1-21(2)14-10-7-13(8-11-14)9-12-17-19-16-6-4-3-5-15(16)18(22)20-17/h3-12H,1-2H3,(H,19,20,22)/b12-9+
InChIKey XCOGSWJYLKIUIA-FMIVXFBMSA-N
SMILES C=1(NC(C=2C(N1)=CC=CC2)=O)\C=C\C1=CC=C(C=C1)N(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.926916