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MEQMSFQLJCSOEJ-UHFFFAOYSA-N
SpectraBase Compound ID H5h0lS8iYE3
InChI InChI=1S/C3H4N2S.C2HF3O2/c4-3-5-1-2-6-3;3-2(4,5)1(6)7/h1-2H,(H2,4,5);(H,6,7)
InChIKey MEQMSFQLJCSOEJ-UHFFFAOYSA-N
Mol Weight 214.16 g/mol
Molecular Formula C5H5F3N2O2S
Exact Mass 214.002383 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID RmhyKTOfPI
Name MEQMSFQLJCSOEJ-UHFFFAOYSA-N
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C5H5F3N2O2S
InChI InChI=1S/C3H4N2S.C2HF3O2/c4-3-5-1-2-6-3;3-2(4,5)1(6)7/h1-2H,(H2,4,5);(H,6,7)
InChIKey MEQMSFQLJCSOEJ-UHFFFAOYSA-N
Literature Reference Author G.TOTH,B.PODANYI
Literature Reference Citation J.CHEM.SOC.PERKIN-2,91(1984)
Literature Reference DOI 10.1039/p29840000091
Molecular Weight 214.162 g/mol
Solvent CF3COOD
Source File Reference UWCS4789