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2-(Benzylamino]-3,4-dihydro-3-(3'-oxo-3'-phenylpropyl)-6-phenyl-nicotinonitrile
SpectraBase Compound ID 2jCkgpxZL8Z
InChI InChI=1S/C28H25N3O/c29-21-28(19-17-26(32)24-14-8-3-9-15-24)18-16-25(23-12-6-2-7-13-23)31-27(28)30-20-22-10-4-1-5-11-22/h1-16H,17-20H2,(H,30,31)
InChIKey CIXNNDFFQLAAGQ-UHFFFAOYSA-N
Mol Weight 419.53 g/mol
Molecular Formula C28H25N3O
Exact Mass 419.199762 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9KjLXYbBz60
Name 2-(Benzylamino]-3,4-dihydro-3-(3'-oxo-3'-phenylpropyl)-6-phenyl-nicotinonitrile
Comments Less than 3 mono-isotopic peaks
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Formula C28H25N3O
InChI InChI=1S/C28H25N3O/c29-21-28(19-17-26(32)24-14-8-3-9-15-24)18-16-25(23-12-6-2-7-13-23)31-27(28)30-20-22-10-4-1-5-11-22/h1-16H,17-20H2,(H,30,31)
InChIKey CIXNNDFFQLAAGQ-UHFFFAOYSA-N
Molecular Weight 419.528 g/mol
SMILES N(C1=NC(=CCC1(C#N)CCC(=O)c1ccccc1)c1ccccc1)Cc1ccccc1
SPLASH splash10-000i-0090100000-fb10630eacae9ebcfff9
Source of Spectrum D8-327-88-11
Synonyms 2-(benzylamino)-3-(3-oxo-3-phenylpropyl)-6-phenyl-3,4-dihydro-3-pyridinecarbonitrile
Wiley ID 1515115