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3,3-dimethyl-1-(4-methylphenyl)sulfonyl-2H-quinolin-4-one
SpectraBase Compound ID Cenep750PO7
InChI InChI=1S/C18H19NO3S/c1-13-8-10-14(11-9-13)23(21,22)19-12-18(2,3)17(20)15-6-4-5-7-16(15)19/h4-11H,12H2,1-3H3
InChIKey IDGGMIHGIQIGMM-UHFFFAOYSA-N
Mol Weight 329.41 g/mol
Molecular Formula C18H19NO3S
Exact Mass 329.108565 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AgBJaJT92Ou
Name 3,3-dimethyl-1-(4-methylphenyl)sulfonyl-2H-quinolin-4-one
CAS Registry Number 112565-67-0
Comments Less than 3 mono-isotopic peaks
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Formula C18H19NO3S
InChI InChI=1S/C18H19NO3S/c1-13-8-10-14(11-9-13)23(21,22)19-12-18(2,3)17(20)15-6-4-5-7-16(15)19/h4-11H,12H2,1-3H3
InChIKey IDGGMIHGIQIGMM-UHFFFAOYSA-N
Molecular Weight 329.414 g/mol
SMILES c12N(S(c3ccc(cc3)C)(=O)=O)CC(C(c1cccc2)=O)(C)C
SPLASH splash10-00i0-0099000000-3bb6d5bd736dc6d0127a
Source of Spectrum KC-1987-1639-21
Synonyms 3,3-dimethyl-1-(p-tolylsulfonyl)-2H-quinolin-4-one 3,3-dimethyl-1-tosyl-2H-quinolin-4-one
Wiley ID 1327082