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3-(methylthio)-4-(phenylmethylthio)quinoline
SpectraBase Compound ID KFIwvhPSzYh
InChI InChI=1S/C17H15NS2/c1-19-16-11-18-15-10-6-5-9-14(15)17(16)20-12-13-7-3-2-4-8-13/h2-11H,12H2,1H3
InChIKey LDZCKEPQZVVFSO-UHFFFAOYSA-N
Mol Weight 297.43 g/mol
Molecular Formula C17H15NS2
Exact Mass 297.064592 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4oVCSYdz5Oz
Name 3-(methylthio)-4-(phenylmethylthio)quinoline
CAS Registry Number 128100-03-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H15NS2
InChI InChI=1S/C17H15NS2/c1-19-16-11-18-15-10-6-5-9-14(15)17(16)20-12-13-7-3-2-4-8-13/h2-11H,12H2,1H3
InChIKey LDZCKEPQZVVFSO-UHFFFAOYSA-N
Molecular Weight 297.434 g/mol
SMILES c1(c2c(cccc2)ncc1SC)SCc1ccccc1
SPLASH splash10-0006-9040000000-b6e9e3bea500095f6fa1
Source of Spectrum O-25-166-1
Synonyms 3-Methylsulfanyl-4-(phenylmethylsulfanyl)quinoline 4-(benzylthio)-3-(methylthio)quinoline 4-Benzylsulfanyl-3-methylsulfanylquinoline
Wiley ID 1300169