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3-Acetyl-2,5-diphenyl-1-N-tosyl-2,5-dihydro-1H-pyrrole
SpectraBase Compound ID HfRjTip1M1p
InChI InChI=1S/C25H23NO3S/c1-18-13-15-22(16-14-18)30(28,29)26-24(20-9-5-3-6-10-20)17-23(19(2)27)25(26)21-11-7-4-8-12-21/h3-17,24-25H,1-2H3
InChIKey BUYQUOLIRSQXRH-UHFFFAOYSA-N
Mol Weight 417.52 g/mol
Molecular Formula C25H23NO3S
Exact Mass 417.139865 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GxejvVSMQUc
Name 3-Acetyl-2,5-diphenyl-1-N-tosyl-2,5-dihydro-1H-pyrrole
Alternate Name(s) 1-{1-[(4-methylphenyl)sulfonyl]-2,5-diphenyl-2,5-dihydro-1H-pyrrol-3-yl}ethanone 2,5-Diphenyl-1-(toluenesulfonyl)-3-acetyl-2,5-dihydropyrrole 3-Acetyl-2,5-diphenyl-1-N-tosyl-1H-pyrrole
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Formula C25H23NO3S
InChI InChI=1S/C25H23NO3S/c1-18-13-15-22(16-14-18)30(28,29)26-24(20-9-5-3-6-10-20)17-23(19(2)27)25(26)21-11-7-4-8-12-21/h3-17,24-25H,1-2H3
InChIKey BUYQUOLIRSQXRH-UHFFFAOYSA-N
Molecular Weight 417.523 g/mol
SMILES c1(S(N2C(C(C(=O)C)=CC2c2ccccc2)c2ccccc2)(=O)=O)ccc(cc1)C
SPLASH splash10-0229-0090000000-59702a1a19926753920e
Source of Spectrum K1-2002-699-2
Wiley ID 1522146