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(4aS,5R)-3-Phenyl-5-(phenylcarbonyl)-2,3,4,4a,5,6-hexahydro-1H-pyrido[1,2-a]quinolino-5-carbonitrile
SpectraBase Compound ID Cr21jbTpgkf
InChI InChI=1S/C27H24N2O/c28-19-27(26(30)21-11-5-2-6-12-21)18-23-13-7-8-14-24(23)29-16-15-22(17-25(27)29)20-9-3-1-4-10-20/h1-14,22,25H,15-18H2/t22?,25-,27-/m0/s1
InChIKey OSEHLPVNJXVZNP-FAHYYQORSA-N
Mol Weight 392.5 g/mol
Molecular Formula C27H24N2O
Exact Mass 392.188863 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GQKhzT3GSZX
Name (4aS,5R)-3-Phenyl-5-(phenylcarbonyl)-2,3,4,4a,5,6-hexahydro-1H-pyrido[1,2-a]quinolino-5-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H24N2O
InChI InChI=1S/C27H24N2O/c28-19-27(26(30)21-11-5-2-6-12-21)18-23-13-7-8-14-24(23)29-16-15-22(17-25(27)29)20-9-3-1-4-10-20/h1-14,22,25H,15-18H2/t22?,25-,27-/m0/s1
InChIKey OSEHLPVNJXVZNP-FAHYYQORSA-N
Molecular Weight 392.502 g/mol
SMILES [C@]1([C@]2(N(CCC(C2)c2ccccc2)c2c(C1)cccc2)[H])(C(=O)c1ccccc1)C#N
SPLASH splash10-0a6u-7955000000-497f1dca273aec7b7876
Source of Spectrum HC-49-742-4b
Synonyms 3-Phenyl-5-(phenylcarbonyl)-2,3,4,4a,5,6-hexahydro-1H-pyrido[1,2-a]quinolino-5-carbonitrile (4aS,5R)-5-benzoyl-3-phenyl-2,3,4,4a,5,6-hexahydro-1H-pyrido[1,2-a]quinoline-5-carbonitrile
Wiley ID 1739049