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JJTNCNPUJNLYPE-UHFFFAOYSA-N
SpectraBase Compound ID 7OVcKth8IWA
InChI InChI=1S/C9H8F3N3S2/c10-9(11,12)7-4-5(6-2-1-3-17-6)15(14-7)8(13)16/h1-3,5H,4H2,(H2,13,16)
InChIKey JJTNCNPUJNLYPE-UHFFFAOYSA-N
Mol Weight 279.3 g/mol
Molecular Formula C9H8F3N3S2
Exact Mass 279.011174 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BCHKrgrNhUi
Name JJTNCNPUJNLYPE-UHFFFAOYSA-N
Compound Number XVIII
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H8F3N3S2
InChI InChI=1S/C9H8F3N3S2/c10-9(11,12)7-4-5(6-2-1-3-17-6)15(14-7)8(13)16/h1-3,5H,4H2,(H2,13,16)
InChIKey JJTNCNPUJNLYPE-UHFFFAOYSA-N
Literature Reference Author A.V.SANIN,V.G.NENAIDENKO,V.S.KUZMIN,E.S.BALENKOVA
Literature Reference Citation CHEM.HET.COMP.,34,558(1998)
Literature Reference DOI 10.1007/bf02290939
Molecular Weight 279.298 g/mol
Solvent CDCl3_OR_CD3CN_OR_CD3OD_OR_DMSO-
Source File Reference UWMZ15166