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8-HEXYLTHIO-5-METHYOXYCARBONYL-QUINOLINE
SpectraBase Compound ID Fx7f6bHET3E
InChI InChI=1S/C17H21NO2S/c1-3-4-5-6-12-21-15-10-9-14(17(19)20-2)13-8-7-11-18-16(13)15/h7-11H,3-6,12H2,1-2H3
InChIKey OVTCKNQWTRYJTG-UHFFFAOYSA-N
Mol Weight 303.42 g/mol
Molecular Formula C17H21NO2S
Exact Mass 303.1293 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CufKQsQ77wQ
Name 8-(hexylthio)-5-quinolinecarboxylic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H21NO2S
InChI InChI=1S/C17H21NO2S/c1-3-4-5-6-12-21-15-10-9-14(17(19)20-2)13-8-7-11-18-16(13)15/h7-11H,3-6,12H2,1-2H3
InChIKey OVTCKNQWTRYJTG-UHFFFAOYSA-N
Molecular Weight 303.420 g/mol
SMILES c1(c2c(nccc2)c(cc1)SCCCCCC)C(=O)OC
SPLASH splash10-02n9-0390000000-fc2950c63e1207ea1244
Source of Spectrum Y-28-664-14
Synonyms 8-(hexylthio)quinoline-5-carboxylic acid methyl ester Methyl 8-hexylsulfanylquinoline-5-carboxylate
Wiley ID 1305606