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(4aS,5R)-5-(Phenylcarbonyl)-2,3,4,4a,5,6-hexahydro-1H-pyrido[1,2-a]quinolino-5-carbonitrile
SpectraBase Compound ID FnhjVALQFeH
InChI InChI=1S/C21H20N2O/c22-15-21(20(24)16-8-2-1-3-9-16)14-17-10-4-5-11-18(17)23-13-7-6-12-19(21)23/h1-5,8-11,19H,6-7,12-14H2/t19-,21-/m0/s1
InChIKey WRCGVDLXQMPPGE-FPOVZHCZSA-N
Mol Weight 316.4 g/mol
Molecular Formula C21H20N2O
Exact Mass 316.157563 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3QsrLrQPZ2
Name (4aS,5R)-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 C21H20N2O
InChI InChI=1S/C21H20N2O/c22-15-21(20(24)16-8-2-1-3-9-16)14-17-10-4-5-11-18(17)23-13-7-6-12-19(21)23/h1-5,8-11,19H,6-7,12-14H2/t19-,21-/m0/s1
InChIKey WRCGVDLXQMPPGE-FPOVZHCZSA-N
Molecular Weight 316.404 g/mol
SMILES [C@]1([C@]2(N(CCCC2)c2c(C1)cccc2)[H])(C(=O)c1ccccc1)C#N
SPLASH splash10-0cmi-5944000000-aaf7cd2b3e8ba5a98b4f
Source of Spectrum HC-49-741-4a
Synonyms 5-(Phenylcarbonyl)-2,3,4,4a,5,6-hexahydro-1H-pyrido[1,2-a]quinolino-5-carbonitrile (4aS,5R)-5-benzoyl-2,3,4,4a,5,6-hexahydro-1H-pyrido[1,2-a]quinoline-5-carbonitrile
Wiley ID 1739353