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2-N-(4-CHLOROPHENYL)-6-NITRO-BENZOTHIAZOLE
SpectraBase Compound ID GcqKP2Dw4oj
InChI InChI=1S/C13H8ClN3O2S/c14-8-1-3-9(4-2-8)15-13-16-11-6-5-10(17(18)19)7-12(11)20-13/h1-7H,(H,15,16)
InChIKey BIRCATJRKXNBHX-UHFFFAOYSA-N
Mol Weight 305.74 g/mol
Molecular Formula C13H8ClN3O2S
Exact Mass 305.002575 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I9mBxjJxLe8
Name 2-N-(4-CHLOROPHENYL)-6-NITRO-BENZOTHIAZOLE
Compound Number 32C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H8ClN3O2S
InChI InChI=1S/C13H8ClN3O2S/c14-8-1-3-9(4-2-8)15-13-16-11-6-5-10(17(18)19)7-12(11)20-13/h1-7H,(H,15,16)
InChIKey BIRCATJRKXNBHX-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 305.738 g/mol
Sample ID 40855
Solvent DMSO-D6