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4(3H)-Pyrimidinone, 3-(4-chlorophenyl)-2-methyl-

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

4(3H)-Pyrimidinone, 3-(4-chlorophenyl)-2-methyl-
SpectraBase Compound ID DHb2Z7Nt3Zi
InChI InChI=1S/C11H9ClN2O/c1-8-13-7-6-11(15)14(8)10-4-2-9(12)3-5-10/h2-7H,1H3
InChIKey USTLDFWGUZXACG-UHFFFAOYSA-N
Mol Weight 220.66 g/mol
Molecular Formula C11H9ClN2O
Exact Mass 220.040341 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Kk6tQCidDg
Name 4(3H)-Pyrimidinone, 3-(4-chlorophenyl)-2-methyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 220.040340617 u
Formula C11H9ClN2O
InChI InChI=1S/C11H9ClN2O/c1-8-13-7-6-11(15)14(8)10-4-2-9(12)3-5-10/h2-7H,1H3
InChIKey USTLDFWGUZXACG-UHFFFAOYSA-N
Molecular Weight 220.659 g/mol
SMILES C1(N(C(=NC=C1)C)C1=CC=C(C=C1)Cl)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.934644