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4-[(1S)-2-(p-tolyl)-3,4-dihydro-1H-isoquinolin-1-yl]butanenitrile
SpectraBase Compound ID FADlW0N18SZ
InChI InChI=1S/C20H22N2/c1-16-9-11-18(12-10-16)22-15-13-17-6-2-3-7-19(17)20(22)8-4-5-14-21/h2-3,6-7,9-12,20H,4-5,8,13,15H2,1H3/t20-/m0/s1
InChIKey KNJDATWFHDILML-FQEVSTJZSA-N
Mol Weight 290.41 g/mol
Molecular Formula C20H22N2
Exact Mass 290.178299 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LuSgwrD36w6
Name 4-[(1S)-2-(p-tolyl)-3,4-dihydro-1H-isoquinolin-1-yl]butanenitrile
Appearance Yellow oily liquid
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Formula C20H22N2
InChI InChI=1S/C20H22N2/c1-16-9-11-18(12-10-16)22-15-13-17-6-2-3-7-19(17)20(22)8-4-5-14-21/h2-3,6-7,9-12,20H,4-5,8,13,15H2,1H3/t20-/m0/s1
InChIKey KNJDATWFHDILML-FQEVSTJZSA-N
Instrument Name LRMS
Ionization Type EI
Molecular Weight 290.410 g/mol
SMILES c1c2c(ccc1)[C@@](N(CC2)c1ccc(cc1)C)(CCCC#N)[H]
SPLASH splash10-00di-2190000000-2ab38052eeb4bfd27059
Source of Spectrum CN114478380A
Wiley ID 1884265