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4-[4-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)but-1-ynyl]isoquinoline
SpectraBase Compound ID CZjOFQyhpRy
InChI InChI=1S/C24H22N2/c1-2-8-20(9-3-1)21-13-16-26(17-14-21)15-7-6-11-23-19-25-18-22-10-4-5-12-24(22)23/h1-5,8-10,12-13,18-19H,7,14-17H2
InChIKey CPBVYXALZPNTBE-UHFFFAOYSA-N
Mol Weight 338.45 g/mol
Molecular Formula C24H22N2
Exact Mass 338.178299 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GIaFgvqI3JS
Name 4-[4-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)but-1-ynyl]isoquinoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H22N2
InChI InChI=1S/C24H22N2/c1-2-8-20(9-3-1)21-13-16-26(17-14-21)15-7-6-11-23-19-25-18-22-10-4-5-12-24(22)23/h1-5,8-10,12-13,18-19H,7,14-17H2
InChIKey CPBVYXALZPNTBE-UHFFFAOYSA-N
Molecular Weight 338.454 g/mol
SMILES c1ncc(c2ccccc12)C#CCCN1CCC(=CC1)c1ccccc1
SPLASH splash10-00di-0900000000-913e625c2de8e245b187
Source of Spectrum E1-39-3184-21
Wiley ID 1598865