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1-(4-methylphenyl)sulfonyl-2-(3-nitrophenyl)pyrrole
SpectraBase Compound ID HvGf1lrlRZe
InChI InChI=1S/C17H14N2O4S/c1-13-7-9-16(10-8-13)24(22,23)18-11-3-6-17(18)14-4-2-5-15(12-14)19(20)21/h2-12H,1H3
InChIKey HMYIGCFCZOPUOI-UHFFFAOYSA-N
Mol Weight 342.37 g/mol
Molecular Formula C17H14N2O4S
Exact Mass 342.067428 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 37FWhUnyZcN
Name 1-(4-methylphenyl)sulfonyl-2-(3-nitrophenyl)pyrrole
Alternate Name(s) 2-(3-nitrophenyl)-1-(p-tolylsulfonyl)pyrrole 2-(3-nitrophenyl)-1-tosyl-pyrrole
Comments Less than 3 mono-isotopic peaks
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Formula C17H14N2O4S
InChI InChI=1S/C17H14N2O4S/c1-13-7-9-16(10-8-13)24(22,23)18-11-3-6-17(18)14-4-2-5-15(12-14)19(20)21/h2-12H,1H3
InChIKey HMYIGCFCZOPUOI-UHFFFAOYSA-N
Molecular Weight 342.369 g/mol
SMILES c1([n](S(c2ccc(cc2)C)(=O)=O)ccc1)-c1cc(N(=O)=O)ccc1
SPLASH splash10-0006-0019000000-fd640b29de410e723d72
Source of Spectrum D1-2003-1996-3
Wiley ID 1548404