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2-(2-chloro-5-nitrophenyl)-2,3-dihydro-4(1H)-quinazolinone

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 Raman

2-(2-chloro-5-nitrophenyl)-2,3-dihydro-4(1H)-quinazolinone
SpectraBase Compound ID ALPcXU5i35d
InChI InChI=1S/C14H10ClN3O3/c15-11-6-5-8(18(20)21)7-10(11)13-16-12-4-2-1-3-9(12)14(19)17-13/h1-7,13,16H,(H,17,19)
InChIKey CAUDLYYKWLPPQU-UHFFFAOYSA-N
Mol Weight 303.7 g/mol
Molecular Formula C14H10ClN3O3
Exact Mass 303.041069 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 8ojoOyb6ij6
Name 2-(2-Chloro-5-nitrophenyl)-2,3-dihydro-4(1H)-quinazolinone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 303.041068891 u
Formula C14H10ClN3O3
InChI InChI=1S/C14H10ClN3O3/c15-11-6-5-8(18(20)21)7-10(11)13-16-12-4-2-1-3-9(12)14(19)17-13/h1-7,13,16H,(H,17,19)
InChIKey CAUDLYYKWLPPQU-UHFFFAOYSA-N
SMILES N1C(C2=CC(=CC=C2Cl)N(=O)=O)NC(C2=C1C=CC=C2)=O
Spectrum/Structure Validation Score (Raman) 0.817681