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methyl 5-nitro-7-(trifluoromethyl)-2-benzothiazolyl ketone, N-oxide
SpectraBase Compound ID ICFj7t2GJj1
InChI InChI=1S/C10H5F3N2O4S/c1-4(16)9-14(17)7-3-5(15(18)19)2-6(8(7)20-9)10(11,12)13/h2-3H,1H3
InChIKey MSWXODFBOFIMIF-UHFFFAOYSA-N
Mol Weight 306.22 g/mol
Molecular Formula C10H5F3N2O4S
Exact Mass 305.992212 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4yYhbVoPtAP
Name methyl 5-nitro-7-(trifluoromethyl)-2-benzothiazolyl ketone, N-oxide
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Formula C10H5F3N2O4S
InChI InChI=1S/C10H5F3N2O4S/c1-4(16)9-14(17)7-3-5(15(18)19)2-6(8(7)20-9)10(11,12)13/h2-3H,1H3
InChIKey MSWXODFBOFIMIF-UHFFFAOYSA-N
Instrument Name Varian A-60D
Sadtler NMR Number 20168M
Solvent Polysol