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2,2-Dimethyl-6-nitro-4-phenyl-1,2-dihydro-quinazoline 3-oxide
SpectraBase Compound ID GBfxj6216oU
InChI InChI=1S/C16H15N3O3/c1-16(2)17-14-9-8-12(19(21)22)10-13(14)15(18(16)20)11-6-4-3-5-7-11/h3-10,17H,1-2H3
InChIKey NULULAJOGTUYSD-UHFFFAOYSA-N
Mol Weight 297.31 g/mol
Molecular Formula C16H15N3O3
Exact Mass 297.111341 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID L74X4n0Y43u
Name 2,2-Dimethyl-6-nitro-4-phenyl-1,2-dihydro-quinazoline 3-oxide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 297.111341352 u
Formula C16H15N3O3
InChI InChI=1S/C16H15N3O3/c1-16(2)17-14-9-8-12(19(21)22)10-13(14)15(18(16)20)11-6-4-3-5-7-11/h3-10,17H,1-2H3
InChIKey NULULAJOGTUYSD-UHFFFAOYSA-N
SMILES C1(=N(C(NC2=CC=C(C=C12)N(=O)=O)(C)C)=O)C1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.886316