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4-BENZYLIDENAMINO-3,5-BIS-(TRIFLUORMETHYL)-1,2,4-TRIAZOLE
SpectraBase Compound ID 7PXrMl1O15P
InChI InChI=1S/C11H6F6N4/c12-10(13,14)8-19-20-9(11(15,16)17)21(8)18-6-7-4-2-1-3-5-7/h1-6H/b18-6+
InChIKey KJZBLJWBHMENDR-NGYBGAFCSA-N
Mol Weight 308.19 g/mol
Molecular Formula C11H6F6N4
Exact Mass 308.049665 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Gqj4ZRsP0eS
Name 4-BENZYLIDENAMINO-3,5-BIS-(TRIFLUORMETHYL)-1,2,4-TRIAZOLE
CAS Registry Number 137233-26-2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H6F6N4
InChI InChI=1S/C11H6F6N4/c12-10(13,14)8-19-20-9(11(15,16)17)21(8)18-6-7-4-2-1-3-5-7/h1-6H/b18-6+
InChIKey KJZBLJWBHMENDR-NGYBGAFCSA-N
Literature Reference Author L.BAUMANN,T.KAEMPCHEN,G.SEITZ
Literature Reference Citation CHEM.BER.,125,171(1992)
Literature Reference DOI 10.1002/cber.19921250128
Molecular Weight 308.186 g/mol
Solvent CDCl3
Source File Reference UWCS8071