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DBXMERFDOYVRJL-UHFFFAOYSA-N
SpectraBase Compound ID 42gc3hZ8G9N
InChI InChI=1S/C15H10ClN3S2/c1-9-7-12(13-3-2-6-20-13)19(18-9)15-17-11-5-4-10(16)8-14(11)21-15/h2-8H,1H3
InChIKey DBXMERFDOYVRJL-UHFFFAOYSA-N
Mol Weight 331.84 g/mol
Molecular Formula C15H10ClN3S2
Exact Mass 331.000467 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5pSISyatz29
Name DBXMERFDOYVRJL-UHFFFAOYSA-N
Compound Number 1055
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H10ClN3S2
InChI InChI=1S/C15H10ClN3S2/c1-9-7-12(13-3-2-6-20-13)19(18-9)15-17-11-5-4-10(16)8-14(11)21-15/h2-8H,1H3
InChIKey DBXMERFDOYVRJL-UHFFFAOYSA-N
Literature Reference Author M.BEGTRUP,G.BOYER,P.CABILDO,C.CATIVIELA,R.M.CLARAMUNT,J.ELGU ERO,J.I.GARCIA,C.TOI
Literature Reference Citation MAGN.RES.CHEM.,31,107(1993)
Literature Reference DOI 10.1002/mrc.1260310202
Molecular Weight 331.838 g/mol
Solvent CDCl3
Source File Reference UWVP1156