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3-(methylthio)-5-(p-tolyl)isoxazole
SpectraBase Compound ID 4S4QHWCwo4R
InChI InChI=1S/C11H11NOS/c1-8-3-5-9(6-4-8)10-7-11(14-2)12-13-10/h3-7H,1-2H3
InChIKey LQMWALWOBLIRME-UHFFFAOYSA-N
Mol Weight 205.27 g/mol
Molecular Formula C11H11NOS
Exact Mass 205.056135 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ezi0dKf6Ep7
Name 3-(methylthio)-5-(p-tolyl)isoxazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11NOS
InChI InChI=1S/C11H11NOS/c1-8-3-5-9(6-4-8)10-7-11(14-2)12-13-10/h3-7H,1-2H3
InChIKey LQMWALWOBLIRME-UHFFFAOYSA-N
Molecular Weight 205.275 g/mol
SMILES c1(noc(c1)-c1ccc(cc1)C)SC
SPLASH splash10-014i-0930000000-36a59a24dbcf6eaa3223
Source of Spectrum SO-0-22-4
Synonyms 3-Methylsulfanyl-5-(p-tolyl)isoxazole 5-(4-Methylphenyl)-3-(methylthio)isoxazole 5-(4-Methylphenyl)-3-methylsulfanyl-1,2-oxazole
Wiley ID 1540422