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3-(PARA-NITROPHENYL)-2-STYRYL-1-TOSYLPYRROLE
SpectraBase Compound ID 5e1vriXOv2r
InChI InChI=1S/C25H20N2O4S/c1-19-7-14-23(15-8-19)32(30,31)26-18-17-24(21-10-12-22(13-11-21)27(28)29)25(26)16-9-20-5-3-2-4-6-20/h2-18H,1H3/b16-9+
InChIKey LFUXGOJNFSANRE-CXUHLZMHSA-N
Mol Weight 444.51 g/mol
Molecular Formula C25H20N2O4S
Exact Mass 444.114378 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5CqvFBHQw4
Name 3-(p-Nitrophenyl)-2-styryl-1-tosylpyrrole
Alternate Name(s) 1-[(4-methylphenyl)sulfonyl]-3-(4-nitrophenyl)-2-[(E)-2-phenylethenyl]-1H-pyrrole
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Formula C25H20N2O4S
InChI InChI=1S/C25H20N2O4S/c1-19-7-14-23(15-8-19)32(30,31)26-18-17-24(21-10-12-22(13-11-21)27(28)29)25(26)16-9-20-5-3-2-4-6-20/h2-18H,1H3/b16-9+
InChIKey LFUXGOJNFSANRE-CXUHLZMHSA-N
Molecular Weight 444.505 g/mol
SMILES c1([n](ccc1-c1ccc(cc1)N(=O)=O)S(=O)(=O)c1ccc(C)cc1)\C=C\c1ccccc1
SPLASH splash10-0006-0090500000-4d95532f1739dace005d
Source of Spectrum I-79-1834-10
Wiley ID 813001