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Ethyl 2-(benzothiazol-2-yl)-3-methyl-5-oxo-2,5-dihydroisoxazole-4-carboxylate

View entire compound with spectra: 1 MS (GC)

Ethyl 2-(benzothiazol-2-yl)-3-methyl-5-oxo-2,5-dihydroisoxazole-4-carboxylate
SpectraBase Compound ID 3XaUBfvVM3e
InChI InChI=1S/C14H12N2O4S/c1-3-19-12(17)11-8(2)16(20-13(11)18)14-15-9-6-4-5-7-10(9)21-14/h4-7H,3H2,1-2H3
InChIKey UAEHIAUSIUQSON-UHFFFAOYSA-N
Mol Weight 304.32 g/mol
Molecular Formula C14H12N2O4S
Exact Mass 304.051778 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DGxQLhfbABA
Name Ethyl 2-(benzothiazol-2-yl)-3-methyl-5-oxo-2,5-dihydroisoxazole-4-carboxylate
Alternate Name(s) Ethyl 2-(1,3-benzothiazol-2-yl)-3-methyl-5-oxo-2,5-dihydro-4-isoxazolecarboxylate
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Formula C14H12N2O4S
InChI InChI=1S/C14H12N2O4S/c1-3-19-12(17)11-8(2)16(20-13(11)18)14-15-9-6-4-5-7-10(9)21-14/h4-7H,3H2,1-2H3
InChIKey UAEHIAUSIUQSON-UHFFFAOYSA-N
Molecular Weight 304.320 g/mol
SMILES c1(N2C(=C(C(=O)OCC)C(O2)=O)C)nc2ccccc2s1
SPLASH splash10-0hg9-0962000000-f95c9a6dbe48a4a274c4
Source of Spectrum B-47-1249-0
Wiley ID 1306109