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5-(methylthio)-3-phenyl-isoxazole

View entire compound with spectra: 1 NMR, and 2 MS (GC)

5-(methylthio)-3-phenyl-isoxazole
SpectraBase Compound ID 8FXyPFaePsi
InChI InChI=1S/C10H9NOS/c1-13-10-7-9(11-12-10)8-5-3-2-4-6-8/h2-7H,1H3
InChIKey CCUUBLRAMGCOOB-UHFFFAOYSA-N
Mol Weight 191.25 g/mol
Molecular Formula C10H9NOS
Exact Mass 191.040485 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LLTZ5MKikJV
Name Isoxazole, 5-(methylthio)-3-phenyl-
CAS Registry Number 25755-80-0
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H9NOS
InChI InChI=1S/C10H9NOS/c1-13-10-7-9(11-12-10)8-5-3-2-4-6-8/h2-7H,1H3
InChIKey CCUUBLRAMGCOOB-UHFFFAOYSA-N
Molecular Weight 191.248 g/mol
SMILES CSc1cc(-c2ccccc2)no1
SPLASH splash10-0v03-7900000000-32519b0222a99baf212c
Source of Spectrum O-5-129-6
Synonyms 5-Methylsulfanyl-3-phenyl-1,2-oxazole 5-Methylsulfanyl-3-phenyl-isoxazole 5-(methylthio)-3-phenyl-isoxazole 5-(methylthio)-3-phenylisoxazole
Wiley ID 20910