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4-(3-Iodophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarbonitrile
SpectraBase Compound ID 4aXaeLFNzSG
InChI InChI=1S/C17H15IN2O/c1-10-13(9-19)16(11-4-2-5-12(18)8-11)17-14(20-10)6-3-7-15(17)21/h2,4-5,8,16,20H,3,6-7H2,1H3
InChIKey KPNXXYIYXHACDV-UHFFFAOYSA-N
Mol Weight 390.22 g/mol
Molecular Formula C17H15IN2O
Exact Mass 390.022908 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AA2EY549ASO
Name 4-(3-Iodophenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarbonitrile
CAS Registry Number 314052-23-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H15IN2O
InChI InChI=1S/C17H15IN2O/c1-10-13(9-19)16(11-4-2-5-12(18)8-11)17-14(20-10)6-3-7-15(17)21/h2,4-5,8,16,20H,3,6-7H2,1H3
InChIKey KPNXXYIYXHACDV-UHFFFAOYSA-N
Molecular Weight 390.224 g/mol
SMILES N1C(=C(C(C2=C1CCCC2=O)c1cc(ccc1)I)C#N)C
SPLASH splash10-000i-2911000000-c160654249b6737978e5
Synonyms 4-(3-iodanylphenyl)-2-methyl-5-oxidanylidene-4,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile 4-(3-Iodo-phenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-quinoline-3-carbonitrile 4-(3-iodophenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile 4-(3-iodophenyl)-5-keto-2-methyl-4,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile
Wiley ID 1459219