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4-Methyl-N-{2-(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)phenyl}benzenesulfonamide
SpectraBase Compound ID FGTqvoMGiSQ
InChI InChI=1S/C21H17N3O3S/c1-15-9-11-16(12-10-15)28(26,27)23-18-7-3-2-6-17(18)19-14-21(25)24-13-5-4-8-20(24)22-19/h2-14,23H,1H3
InChIKey PGSTWKSXANBZCL-UHFFFAOYSA-N
Mol Weight 391.45 g/mol
Molecular Formula C21H17N3O3S
Exact Mass 391.099063 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EQetSPD2u
Name 4-Methyl-N-{2-(4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)phenyl}benzenesulfonamide
Appearance Colorless solid
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Exact Mass 391.099062590 u
Formula C21H17N3O3S
InChI InChI=1S/C21H17N3O3S/c1-15-9-11-16(12-10-15)28(26,27)23-18-7-3-2-6-17(18)19-14-21(25)24-13-5-4-8-20(24)22-19/h2-14,23H,1H3
InChIKey PGSTWKSXANBZCL-UHFFFAOYSA-N
Instrument Name Jeol AccuTOF
Ionization Type EI
Literature Reference DOI 10.1002/anie.201801111
Molecular Weight 391.445 g/mol
Quality 108
SMILES N(C1=C(C=CC=C1)C=1N=C2N(C(C1)=O)C=CC=C2)S(C1=CC=C(C=C1)C)(=O)=O
SPLASH splash10-08fu-1093000000-de96a1ae54d9a5887415
Source of Spectrum ACI-57-SM50-15 (DOI: 10.1002/anie.201801111)
Wiley ID 1892946