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3-Butyl-4-chloro-1-phenylquinolin-2-one

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

3-Butyl-4-chloro-1-phenylquinolin-2-one
SpectraBase Compound ID gGDpi2ewJg
InChI InChI=1S/C19H18ClNO/c1-2-3-11-16-18(20)15-12-7-8-13-17(15)21(19(16)22)14-9-5-4-6-10-14/h4-10,12-13H,2-3,11H2,1H3
InChIKey QSEWQCMEJZPYBJ-UHFFFAOYSA-N
Mol Weight 311.81 g/mol
Molecular Formula C19H18ClNO
Exact Mass 311.107692 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID GtBUls53ioL
Name 3-Butyl-4-chloro-1-phenylquinolin-2-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 311.107691903 u
Formula C19H18ClNO
InChI InChI=1S/C19H18ClNO/c1-2-3-11-16-18(20)15-12-7-8-13-17(15)21(19(16)22)14-9-5-4-6-10-14/h4-10,12-13H,2-3,11H2,1H3
InChIKey QSEWQCMEJZPYBJ-UHFFFAOYSA-N
Molecular Weight 311.812 g/mol
SMILES C1(C(=C(Cl)C=2C(N1C=1C=CC=CC1)=CC=CC2)CCCC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.824664