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2-[2-Chloro-7-(methylthio)quinolin-3-yl]-2-methylpropanal
SpectraBase Compound ID Gsc7991stYK
InChI InChI=1S/C14H14ClNOS/c1-14(2,8-17)11-6-9-4-5-10(18-3)7-12(9)16-13(11)15/h4-8H,1-3H3
InChIKey OONNZFFZSSHEEU-UHFFFAOYSA-N
Mol Weight 279.78 g/mol
Molecular Formula C14H14ClNOS
Exact Mass 279.048463 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lpp91Jg6kJy
Name 2-[2-Chloro-7-(methylthio)quinolin-3-yl]-2-methylpropanal
Appearance Dark viscous oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14ClNOS
InChI InChI=1S/C14H14ClNOS/c1-14(2,8-17)11-6-9-4-5-10(18-3)7-12(9)16-13(11)15/h4-8H,1-3H3
InChIKey OONNZFFZSSHEEU-UHFFFAOYSA-N
Instrument Name HP 6890 Series
Ionization Type EI
Literature Reference DOI 10.1002/anie.201814193
Molecular Weight 279.785 g/mol
SMILES c1(Cl)c(C(C)(C)C=O)cc2ccc(SC)cc2n1
SPLASH splash10-0w29-0490000000-97b6b53400ac6c2088ce
Source of Spectrum ACI-58-SM24-S20
Thin-Layer Chromatography Rf = 0.53 (Cy/EtOAc, 2:1)
Wiley ID 1843120