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5-Methyl-6-oxo-2-(phenylthio)-1,3-oxazine-4-carboxylic acid ethyl ester
SpectraBase Compound ID 5RSS0SjOenj
InChI InChI=1S/C14H13NO4S/c1-3-18-13(17)11-9(2)12(16)19-14(15-11)20-10-7-5-4-6-8-10/h4-8H,3H2,1-2H3
InChIKey MYJAYKVMXVGBAC-UHFFFAOYSA-N
Mol Weight 291.32 g/mol
Molecular Formula C14H13NO4S
Exact Mass 291.056529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4nD2HO3z59g
Name 5-Methyl-6-oxo-2-(phenylthio)-1,3-oxazine-4-carboxylic acid ethyl ester
Alternate Name(s) 6-keto-5-methyl-2-(phenylthio)-1,3-oxazine-4-carboxylic acid ethyl ester Ethyl 5-methyl-6-oxidanylidene-2-phenylsulfanyl-1,3-oxazine-4-carboxylate Ethyl 5-methyl-6-oxo-2-phenylsulfanyl-1,3-oxazine-4-carboxylate
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Formula C14H13NO4S
InChI InChI=1S/C14H13NO4S/c1-3-18-13(17)11-9(2)12(16)19-14(15-11)20-10-7-5-4-6-8-10/h4-8H,3H2,1-2H3
InChIKey MYJAYKVMXVGBAC-UHFFFAOYSA-N
Molecular Weight 291.321 g/mol
SMILES C1(=C(N=C(OC1=O)Sc1ccccc1)C(=O)OCC)C
SPLASH splash10-001i-1900000000-67aed697190f2444bb7b
Source of Spectrum KC-0-2676-22
Wiley ID 823486