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3-Methyl-5-oxo-2-isoxazolecarbothioic acid O-phenyl ester
SpectraBase Compound ID IOeldRHqcsN
InChI InChI=1S/C11H9NO3S/c1-8-7-10(13)15-12(8)11(16)14-9-5-3-2-4-6-9/h2-7H,1H3
InChIKey UVVIXNKASOSGMS-UHFFFAOYSA-N
Mol Weight 235.26 g/mol
Molecular Formula C11H9NO3S
Exact Mass 235.030314 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GRojNcktOln
Name 3-Methyl-5-oxo-2-isoxazolecarbothioic acid O-phenyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H9NO3S
InChI InChI=1S/C11H9NO3S/c1-8-7-10(13)15-12(8)11(16)14-9-5-3-2-4-6-9/h2-7H,1H3
InChIKey UVVIXNKASOSGMS-UHFFFAOYSA-N
Molecular Weight 235.257 g/mol
SMILES C=1(N(OC(C1)=O)C(=S)Oc1ccccc1)C
SPLASH splash10-03fr-3900000000-ffa4a96ad53365ac8dbf
Source of Spectrum KC-0-3249-18
Synonyms 5-keto-3-methyl-3-isoxazoline-2-carbothioic acid O-phenyl ester O-phenyl 3-methyl-5-oxidanylidene-1,2-oxazole-2-carbothioate O-phenyl 3-methyl-5-oxo-1,2-oxazole-2-carbothioate O-phenyl 3-methyl-5-oxo-isoxazole-2-carbothioate
Wiley ID 826607