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2-ethyl-4-(4-methylphenyl)sulfonyl-1,4-dihydroisoquinolin-3-one
SpectraBase Compound ID 5cYhAS1Uzbd
InChI InChI=1S/C18H19NO3S/c1-3-19-12-14-6-4-5-7-16(14)17(18(19)20)23(21,22)15-10-8-13(2)9-11-15/h4-11,17H,3,12H2,1-2H3
InChIKey IZNYQBJJSJWKKC-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 JPMBj98k4Rz
Name 2-ethyl-4-(4-methylphenyl)sulfonyl-1,4-dihydroisoquinolin-3-one
Comments Less than 3 mono-isotopic peaks
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Formula C18H19NO3S
InChI InChI=1S/C18H19NO3S/c1-3-19-12-14-6-4-5-7-16(14)17(18(19)20)23(21,22)15-10-8-13(2)9-11-15/h4-11,17H,3,12H2,1-2H3
InChIKey IZNYQBJJSJWKKC-UHFFFAOYSA-N
Molecular Weight 329.414 g/mol
SMILES C1(S(c2ccc(cc2)C)(=O)=O)C(N(CC)Cc2c1cccc2)=O
SPLASH splash10-0002-0900000000-1a872365de102362c1cb
Source of Spectrum J-59-6118-5
Synonyms 2-ethyl-4-(p-tolylsulfonyl)-1,4-dihydroisoquinolin-3-one 2-ethyl-4-tosyl-1,4-dihydroisoquinolin-3-one
Wiley ID 1327088