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(4Z)-3-Methyl-4-[4-(methylsulfanyl)benzylidene]-5(4H)-isoxazolone
SpectraBase Compound ID EyYCXjJyh17
InChI InChI=1S/C12H11NO2S/c1-8-11(12(14)15-13-8)7-9-3-5-10(16-2)6-4-9/h3-7H,1-2H3/b11-7-
InChIKey RHZAVLPYPYVIKW-XFFZJAGNSA-N
Mol Weight 233.28 g/mol
Molecular Formula C12H11NO2S
Exact Mass 233.05105 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3L9lfosBqO2
Name (4Z)-3-Methyl-4-[4-(methylsulfanyl)benzylidene]-5(4H)-isoxazolone
CAS Registry Number 146795-09-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11NO2S
InChI InChI=1S/C12H11NO2S/c1-8-11(12(14)15-13-8)7-9-3-5-10(16-2)6-4-9/h3-7H,1-2H3/b11-7-
InChIKey RHZAVLPYPYVIKW-XFFZJAGNSA-N
Molecular Weight 233.285 g/mol
SMILES C1(\C(C(=NO1)C)=C/c1ccc(cc1)SC)=O
SPLASH splash10-001i-4940000000-a922f419fdef1012b9cb
Synonyms (4Z)-3-methyl-4-[(4-methylsulfanylphenyl)methylene]isoxazol-5-one (4Z)-3-methyl-4-[(4-methylsulfanylphenyl)methylidene]-1,2-oxazol-5-one (4Z)-3-methyl-4-[4-(methylthio)benzylidene]-2-isoxazolin-5-one (4Z)-3-methyl-4-[[4-(methylthio)phenyl]methylidene]-5-isoxazolone 3-Methyl-4-(4-methylsulfanyl-benzylidene)-4H-isoxazol-5-one
Wiley ID 1460954