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3-[3-(Dibenzylamino)-1-phenyl-5-(pyridin-2-yl)-1H-pyrrol-2-yl]propanenitrile
SpectraBase Compound ID IWFdNVhlFLd
InChI InChI=1S/C32H28N4/c33-21-12-20-30-32(35(24-26-13-4-1-5-14-26)25-27-15-6-2-7-16-27)23-31(29-19-10-11-22-34-29)36(30)28-17-8-3-9-18-28/h1-11,13-19,22-23H,12,20,24-25H2
InChIKey BTYSOBKLLDOKND-UHFFFAOYSA-N
Mol Weight 468.6 g/mol
Molecular Formula C32H28N4
Exact Mass 468.231397 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JBhObHNRErd
Name 3-[3-(Dibenzylamino)-1-phenyl-5-(pyridin-2-yl)-1H-pyrrol-2-yl]propanenitrile
Appearance Brown oil
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Formula C32H28N4
InChI InChI=1S/C32H28N4/c33-21-12-20-30-32(35(24-26-13-4-1-5-14-26)25-27-15-6-2-7-16-27)23-31(29-19-10-11-22-34-29)36(30)28-17-8-3-9-18-28/h1-11,13-19,22-23H,12,20,24-25H2
InChIKey BTYSOBKLLDOKND-UHFFFAOYSA-N
Instrument Name Agilent 5763
Ionization Type EI
Literature Reference DOI 10.1002/adsc.201900837
Molecular Weight 468.604 g/mol
Reported Formula C32H28N4
SMILES C(CCc1[n](c(cc1N(Cc1ccccc1)Cc1ccccc1)-c1ccccn1)-c1ccccc1)#N
SPLASH splash10-00p0-2039700000-d788cb4ec89599561061
Source of Spectrum ASC-361-SM28-9sa
Thin-Layer Chromatography Rf = 0.25 (hexane/EtOAc, 8:2)
Wiley ID 1838096