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1-Ethanone, 1-[4-[(4-methylphenyl)sulfonyl]-3-nitrophenyl]-
SpectraBase Compound ID 7qRxmNrcquw
InChI InChI=1S/C15H13NO5S/c1-10-3-6-13(7-4-10)22(20,21)15-8-5-12(11(2)17)9-14(15)16(18)19/h3-9H,1-2H3
InChIKey MGWMPHWYXWFUTF-UHFFFAOYSA-N
Mol Weight 319.33 g/mol
Molecular Formula C15H13NO5S
Exact Mass 319.051444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5sGj0tkkUKr
Name 1-Ethanone, 1-[4-[(4-methylphenyl)sulfonyl]-3-nitrophenyl]-
Alternate Name(s) 1-(3-nitro-4-tosyl-phenyl)ethanone 1-[3-nitro-4-(p-tolylsulfonyl)phenyl]ethanone 1-{4-[(4-methylphenyl)sulfonyl]-3-nitrophenyl}ethanone 1-[4-(4-methylphenyl)sulfonyl-3-nitrophenyl]ethanone 1-[4-(4-methylphenyl)sulfonyl-3-nitro-phenyl]ethanone
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Formula C15H13NO5S
InChI InChI=1S/C15H13NO5S/c1-10-3-6-13(7-4-10)22(20,21)15-8-5-12(11(2)17)9-14(15)16(18)19/h3-9H,1-2H3
InChIKey MGWMPHWYXWFUTF-UHFFFAOYSA-N
Molecular Weight 319.331 g/mol
SMILES CC(=O)c1ccc(c(c1)N(=O)=O)S(=O)(=O)c1ccc(cc1)C
SPLASH splash10-0a4l-9600000000-1bbd2b70fed08c290123
Source of Spectrum IY-1-4441-7
Wiley ID 1652400