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(N)-N-[(3-Nitrophenyl)-5-oxocyclopent-1-enyl)methyl]-4-methylbenzenesulfonamide
SpectraBase Compound ID B2oHYPCPOVb
InChI InChI=1S/C19H18N2O5S/c1-13-8-10-16(11-9-13)27(25,26)20-19(17-6-3-7-18(17)22)14-4-2-5-15(12-14)21(23)24/h2,4-6,8-12,19-20H,3,7H2,1H3
InChIKey WUYOQWFBOUINTB-UHFFFAOYSA-N
Mol Weight 386.42 g/mol
Molecular Formula C19H18N2O5S
Exact Mass 386.093643 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5AisaUua3jY
Name (N)-N-[(3-Nitrophenyl)-5-oxocyclopent-1-enyl)methyl]-4-methylbenzenesulfonamide
Comments Less than 3 mono-isotopic peaks
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Formula C19H18N2O5S
InChI InChI=1S/C19H18N2O5S/c1-13-8-10-16(11-9-13)27(25,26)20-19(17-6-3-7-18(17)22)14-4-2-5-15(12-14)21(23)24/h2,4-6,8-12,19-20H,3,7H2,1H3
InChIKey WUYOQWFBOUINTB-UHFFFAOYSA-N
Molecular Weight 386.422 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)C(C=1C(=O)CCC1)c1cc(N(=O)=O)ccc1
SPLASH splash10-001i-0090000000-2ff2d2cddb7199439ecd
Source of Spectrum KD-16-1390-2
Synonyms 4-methyl-N-[(3-nitrophenyl)-(5-oxo-1-cyclopentenyl)methyl]benzenesulfonamide 4-methyl-N-[(3-nitrophenyl)-(5-oxocyclopenten-1-yl)methyl]benzenesulfonamide 4-methyl-N-[(3-nitrophenyl)-(5-oxidanylidenecyclopenten-1-yl)methyl]benzenesulfonamide
Wiley ID 1637650