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2-[2-Chloro-7-(methylthio)quinolin-3-yl]-2-methylpropan-1-ol
SpectraBase Compound ID 89fKCHNU4yU
InChI InChI=1S/C14H16ClNOS/c1-14(2,8-17)11-6-9-4-5-10(18-3)7-12(9)16-13(11)15/h4-7,17H,8H2,1-3H3
InChIKey KVJFFJKPWJVPCL-UHFFFAOYSA-N
Mol Weight 281.8 g/mol
Molecular Formula C14H16ClNOS
Exact Mass 281.064113 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HiYYeF8Yb7o
Name 2-[2-Chloro-7-(methylthio)quinolin-3-yl]-2-methylpropan-1-ol
Appearance Colorless solid
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Formula C14H16ClNOS
InChI InChI=1S/C14H16ClNOS/c1-14(2,8-17)11-6-9-4-5-10(18-3)7-12(9)16-13(11)15/h4-7,17H,8H2,1-3H3
InChIKey KVJFFJKPWJVPCL-UHFFFAOYSA-N
Instrument Name HP 6890 Series
Ionization Type EI
Literature Reference DOI 10.1002/anie.201814193
Molecular Weight 281.801 g/mol
Reported Formula C14H16ClNOS
SMILES OCC(c1c(Cl)nc2cc(ccc2c1)SC)(C)C
SPLASH splash10-0uea-0390000000-07bbf7d3528fc6b0436a
Source of Spectrum ACI-58-SM21-S15
Thin-Layer Chromatography Rf = 0.37 (Cy/EtOAc, 2:1)
Wiley ID 1843115