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1-Methyl-3-(4-methylphenacylthio)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
SpectraBase Compound ID CjFl5GnE3lM
InChI InChI=1S/C20H20N2OS/c1-13-7-9-15(10-8-13)19(23)12-24-20-18(11-21)17-6-4-3-5-16(17)14(2)22-20/h7-10H,3-6,12H2,1-2H3
InChIKey ALTSSFUTGSQBLL-UHFFFAOYSA-N
Mol Weight 336.45 g/mol
Molecular Formula C20H20N2OS
Exact Mass 336.129634 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9yDAJITX22v
Name 1-METHYL-3-(4-METHYLPHENACYLTHIO)-5,6,7,8-TETRAHYDROISOQUINOLINE-4-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C20H20N2OS
InChI InChI=1S/C20H20N2OS/c1-13-7-9-15(10-8-13)19(23)12-24-20-18(11-21)17-6-4-3-5-16(17)14(2)22-20/h7-10H,3-6,12H2,1-2H3
InChIKey ALTSSFUTGSQBLL-UHFFFAOYSA-N
Molecular Weight 336.1292
SMILES C1Cc2c(C)nc(SCC(c3ccc(C)cc3)=O)c(C#N)c2CC1
SPLASH splash10-014i-8910000000-c06168f264ee583f36ae
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany