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YDOSNWWNIIXJIQ-BQYQJAHWSA-N
SpectraBase Compound ID KuVL9LdvoOn
InChI InChI=1S/C13H13NOS/c1-10-3-5-11(6-4-10)7-8-12-9-13(16-2)14-15-12/h3-9H,1-2H3/b8-7+
InChIKey YDOSNWWNIIXJIQ-BQYQJAHWSA-N
Mol Weight 231.31 g/mol
Molecular Formula C13H13NOS
Exact Mass 231.071785 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6NuhYoCo8m3
Name 3-(methylthio)-5-[(E)-2-(p-tolyl)vinyl]isoxazole
Alternate Name(s) 3-Methylsulfanyl-5-[(E)-2-(p-tolyl)vinyl]isoxazole 5-[(E)-2-(4-methylphenyl)ethenyl]-3-(methylthio)isoxazole 5-[(E)-2-(4-methylphenyl)ethenyl]-3-methylsulfanyl-1,2-oxazole
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Formula C13H13NOS
InChI InChI=1S/C13H13NOS/c1-10-3-5-11(6-4-10)7-8-12-9-13(16-2)14-15-12/h3-9H,1-2H3/b8-7+
InChIKey YDOSNWWNIIXJIQ-BQYQJAHWSA-N
Molecular Weight 231.313 g/mol
SMILES c1(noc(c1)\C=C\c1ccc(cc1)C)SC
SPLASH splash10-000t-0940000000-43ef079ec84498822a2d
Source of Spectrum Y-28-1345-3
Wiley ID 1232737