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2-N-(3-CHLORO-4-METHYLPHENYL)-6-NITRO-BENZOTHIAZOLE
SpectraBase Compound ID C29qUzbOMSV
InChI InChI=1S/C14H10ClN3O2S/c1-8-2-3-9(6-11(8)15)16-14-17-12-5-4-10(18(19)20)7-13(12)21-14/h2-7H,1H3,(H,16,17)
InChIKey NFURCYRAUOOYLL-UHFFFAOYSA-N
Mol Weight 319.77 g/mol
Molecular Formula C14H10ClN3O2S
Exact Mass 319.018225 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7Xcm68kACOB
Name 2-N-(3-CHLORO-4-METHYLPHENYL)-6-NITRO-BENZOTHIAZOLE
Compound Number 36C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H10ClN3O2S
InChI InChI=1S/C14H10ClN3O2S/c1-8-2-3-9(6-11(8)15)16-14-17-12-5-4-10(18(19)20)7-13(12)21-14/h2-7H,1H3,(H,16,17)
InChIKey NFURCYRAUOOYLL-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 319.765 g/mol
Sample ID 40859
Solvent DMSO-D6