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methyl 2-methoxy-4-[(6-nitro-1,3-benzothiazol-2-yl)amino]benzoate
SpectraBase Compound ID KuMK3lFvXMw
InChI InChI=1S/C16H13N3O5S/c1-23-13-7-9(3-5-11(13)15(20)24-2)17-16-18-12-6-4-10(19(21)22)8-14(12)25-16/h3-8H,1-2H3,(H,17,18)
InChIKey JAZJOFYSDZEADU-UHFFFAOYSA-N
Mol Weight 359.36 g/mol
Molecular Formula C16H13N3O5S
Exact Mass 359.057592 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JsCdgi6LViO
Name methyl 2-methoxy-4-[(6-nitro-1,3-benzothiazol-2-yl)amino]benzoate
Compound Number 39C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H13N3O5S
InChI InChI=1S/C16H13N3O5S/c1-23-13-7-9(3-5-11(13)15(20)24-2)17-16-18-12-6-4-10(19(21)22)8-14(12)25-16/h3-8H,1-2H3,(H,17,18)
InChIKey JAZJOFYSDZEADU-UHFFFAOYSA-N
Literature Reference Author S.BILLEAU,F.CHATEL,M.ROBIN,R.FAURE,J.P.GALY
Literature Reference Citation MAGN.RES.CHEM.,44,102(2006)
Literature Reference DOI 10.1002/mrc.1704
Molecular Weight 359.356 g/mol
Sample ID 40862
Solvent DMSO-D6