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2-[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]-2H-1,4-benzothiazin-3(4H)-one

View entire compound with spectra: 1 MS (GC)

2-[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]-2H-1,4-benzothiazin-3(4H)-one
SpectraBase Compound ID 16nOH8F9OTi
InChI InChI=1S/C21H20N2OS/c1-13-8-10-16(11-9-13)23-14(2)12-17(15(23)3)20-21(24)22-18-6-4-5-7-19(18)25-20/h4-12,20H,1-3H3,(H,22,24)
InChIKey UWQOQYDMOPEFDL-UHFFFAOYSA-N
Mol Weight 348.46 g/mol
Molecular Formula C21H20N2OS
Exact Mass 348.129634 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3xlnhgsM9g
Name 2-[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]-2H-1,4-benzothiazin-3(4H)-one
Alternate Name(s) 2-[2,5-dimethyl-1-(4-methylphenyl)-3-pyrrolyl]-4H-1,4-benzothiazin-3-one 2-[2,5-dimethyl-1-(4-methylphenyl)pyrrol-3-yl]-4H-1,4-benzothiazin-3-one 2-[2,5-dimethyl-1-(p-tolyl)pyrrol-3-yl]-4H-1,4-benzothiazin-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H20N2OS
InChI InChI=1S/C21H20N2OS/c1-13-8-10-16(11-9-13)23-14(2)12-17(15(23)3)20-21(24)22-18-6-4-5-7-19(18)25-20/h4-12,20H,1-3H3,(H,22,24)
InChIKey UWQOQYDMOPEFDL-UHFFFAOYSA-N
Molecular Weight 348.464 g/mol
SMILES N1c2ccccc2SC(C1=O)c1c([n](-c2ccc(cc2)C)c(c1)C)C
SPLASH splash10-0002-0509000000-e8e474fe16c605fec5f3
Source of Spectrum CV-2004-1199-19
Wiley ID 1611371