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4-Methyl-6-isopropyl-3-phenylsulfonyl-2(1H)-pyridone

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

4-Methyl-6-isopropyl-3-phenylsulfonyl-2(1H)-pyridone
SpectraBase Compound ID 22nVspGUFvZ
InChI InChI=1S/C15H17NO3S/c1-10(2)13-9-11(3)14(15(17)16-13)20(18,19)12-7-5-4-6-8-12/h4-10H,1-3H3,(H,16,17)
InChIKey QFUHETNSLRXREF-UHFFFAOYSA-N
Mol Weight 291.37 g/mol
Molecular Formula C15H17NO3S
Exact Mass 291.092915 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID B5Xnu5j5Sql
Name 4-Methyl-6-isopropyl-3-phenylsulfonyl-2(1H)-pyridone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 291.092914582 u
Formula C15H17NO3S
InChI InChI=1S/C15H17NO3S/c1-10(2)13-9-11(3)14(15(17)16-13)20(18,19)12-7-5-4-6-8-12/h4-10H,1-3H3,(H,16,17)
InChIKey QFUHETNSLRXREF-UHFFFAOYSA-N
SMILES C=1(S(=O)(=O)C=2C=CC=CC2)C(NC(C(C)C)=CC1C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.883995