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2-(5,6,7,8-Tetrahydro-3-phenylisoquinolin-1-yl)pyridin-3-carbonitrile
SpectraBase Compound ID LMUh6eZS3gk
InChI InChI=1S/C21H17N3/c22-14-17-10-6-12-23-20(17)21-18-11-5-4-9-16(18)13-19(24-21)15-7-2-1-3-8-15/h1-3,6-8,10,12-13H,4-5,9,11H2
InChIKey SPEWQTLHELFKGS-UHFFFAOYSA-N
Mol Weight 311.39 g/mol
Molecular Formula C21H17N3
Exact Mass 311.142248 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K1Kwq7EsbhW
Name 2-(5,6,7,8-Tetrahydro-3-phenylisoquinolin-1-yl)pyridin-3-carbonitrile
Alternate Name(s) 2-(3-phenyl-5,6,7,8-tetrahydro-1-isoquinolinyl)nicotinonitrile
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Formula C21H17N3
InChI InChI=1S/C21H17N3/c22-14-17-10-6-12-23-20(17)21-18-11-5-4-9-16(18)13-19(24-21)15-7-2-1-3-8-15/h1-3,6-8,10,12-13H,4-5,9,11H2
InChIKey SPEWQTLHELFKGS-UHFFFAOYSA-N
Molecular Weight 311.388 g/mol
SMILES c1(c(cccn1)C#N)-c1nc(cc2CCCCc12)-c1ccccc1
SPLASH splash10-03di-0069000000-85e70190668cc32a9dc0
Source of Spectrum QC-17-3188-3
Wiley ID 1638614