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3-TRIFLUOROMETHYL-5,6-DIHYDRO-1,4-H-CYCLOPENTA-[D]-PYRAZOLE
SpectraBase Compound ID KlOA5IjFUSt
InChI InChI=1S/C7H7F3N2/c8-7(9,10)6-4-2-1-3-5(4)11-12-6/h1-3H2,(H,11,12)
InChIKey STVFXOQFVSGNKN-UHFFFAOYSA-N
Mol Weight 176.14 g/mol
Molecular Formula C7H7F3N2
Exact Mass 176.056133 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Bu2lwE3cKb9
Name 3-TRIFLUOROMETHYL-5,6-DIHYDRO-1,4-H-CYCLOPENTA-[D]-PYRAZOLE
Compound Number 2A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H7F3N2
InChI InChI=1S/C7H7F3N2/c8-7(9,10)6-4-2-1-3-5(4)11-12-6/h1-3H2,(H,11,12)
InChIKey STVFXOQFVSGNKN-UHFFFAOYSA-N
Literature Reference Author D.V.SEVENARD,O.G.KHOMUTOV,M.I.KODESS,K.I.PASHKEVICH,I.LOOP,E .LORK,G.V.ROESCHENT
Literature Reference Citation CAN.J.CHEM.,79,183(2001)
Literature Reference DOI 10.1139/cjc-79-2-183
Molecular Weight 176.141 g/mol
Solvent CDCl3
Source File Reference UWSI16020