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O-{[(3,5-bis(methylthio)-4-isothiazolyl]carbonyl}-2-chloroacetamidoxime
SpectraBase Compound ID EttI07MwYDU
InChI InChI=1S/C8H10ClN3O2S3/c1-15-6-5(8(16-2)17-12-6)7(13)14-11-4(10)3-9/h3H2,1-2H3,(H2,10,11)
InChIKey XKPDJYRYSKDLJJ-UHFFFAOYSA-N
Mol Weight 311.82 g/mol
Molecular Formula C8H10ClN3O2S3
Exact Mass 310.962368 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HoERrdlEgh1
Name O-{[(3,5-bis(methylthio)-4-isothiazolyl]carbonyl}-2-chloroacetamidoxime
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Formula C8H10ClN3O2S3
InChI InChI=1S/C8H10ClN3O2S3/c1-15-6-5(8(16-2)17-12-6)7(13)14-11-4(10)3-9/h3H2,1-2H3,(H2,10,11)
InChIKey XKPDJYRYSKDLJJ-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 56547M
Solvent DMSO-d6