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(4aS,5R)-2,4-Dimethyl-5-(phenylcarbonyl)-2,3,4,4a,5,6-hexahydro-1H-pyrido[1,2-a]quinolino-5-carbonitrile
SpectraBase Compound ID F9fnk78IjHd
InChI InChI=1S/C23H24N2O/c1-16-12-17(2)21-23(15-24,22(26)18-8-4-3-5-9-18)13-19-10-6-7-11-20(19)25(21)14-16/h3-11,16-17,21H,12-14H2,1-2H3/t16?,17?,21-,23-/m0/s1
InChIKey MEYHFJBAZQHEFP-UWVZTXBLSA-N
Mol Weight 344.46 g/mol
Molecular Formula C23H24N2O
Exact Mass 344.188863 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Met28koXW0
Name (4aS,5R)-2,4-Dimethyl-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 C23H24N2O
InChI InChI=1S/C23H24N2O/c1-16-12-17(2)21-23(15-24,22(26)18-8-4-3-5-9-18)13-19-10-6-7-11-20(19)25(21)14-16/h3-11,16-17,21H,12-14H2,1-2H3/t16?,17?,21-,23-/m0/s1
InChIKey MEYHFJBAZQHEFP-UWVZTXBLSA-N
Molecular Weight 344.458 g/mol
SMILES [C@]1([C@]2(N(CC(CC2C)C)c2c(C1)cccc2)[H])(C(=O)c1ccccc1)C#N
SPLASH splash10-0a6u-5926000000-8847efec0e6cae2e3741
Source of Spectrum HC-49-742-4e
Synonyms 2,4-Dimethyl-5-(phenylcarbonyl)-2,3,4,4a,5,6-hexahydro-1H-pyrido[1,2-a]quinolino-5-carbonitrile (4aS,5R)-5-benzoyl-2,4-dimethyl-2,3,4,4a,5,6-hexahydro-1H-pyrido[1,2-a]quinoline-5-carbonitrile
Wiley ID 1739350