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7-Chloro-2-ethyl-2,3-dimethyl-2,3-dihydroquinazolin-4(1H)-one

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

7-Chloro-2-ethyl-2,3-dimethyl-2,3-dihydroquinazolin-4(1H)-one
SpectraBase Compound ID BToCtYix8do
InChI InChI=1S/C12H15ClN2O/c1-4-12(2)14-10-7-8(13)5-6-9(10)11(16)15(12)3/h5-7,14H,4H2,1-3H3
InChIKey NKRIBZYLZYFDJG-UHFFFAOYSA-N
Mol Weight 238.72 g/mol
Molecular Formula C12H15ClN2O
Exact Mass 238.087291 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 71wFwMtu1Mg
Name 7-Chloro-2-ethyl-2,3-dimethyl-2,3-dihydroquinazolin-4(1H)-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 238.087290810 u
Formula C12H15ClN2O
InChI InChI=1S/C12H15ClN2O/c1-4-12(2)14-10-7-8(13)5-6-9(10)11(16)15(12)3/h5-7,14H,4H2,1-3H3
InChIKey NKRIBZYLZYFDJG-UHFFFAOYSA-N
Molecular Weight 238.718 g/mol
SMILES C(C1(C)NC2=CC(=CC=C2C(N1C)=O)Cl)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.901999