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3-PERFLUOROBUTYL-4,5,6,7-TETRAHYDRO-1H-INDAZOLE
SpectraBase Compound ID 1MZTw3XiOL6
InChI InChI=1S/C11H9F9N2/c12-8(13,9(14,15)10(16,17)11(18,19)20)7-5-3-1-2-4-6(5)21-22-7/h1-4H2,(H,21,22)
InChIKey WLUXBABHJQVFMA-UHFFFAOYSA-N
Mol Weight 340.19 g/mol
Molecular Formula C11H9F9N2
Exact Mass 340.062202 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DEmo53qsGbZ
Name 3-PERFLUOROBUTYL-4,5,6,7-TETRAHYDRO-1H-INDAZOLE
Compound Number 2E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H9F9N2
InChI InChI=1S/C11H9F9N2/c12-8(13,9(14,15)10(16,17)11(18,19)20)7-5-3-1-2-4-6(5)21-22-7/h1-4H2,(H,21,22)
InChIKey WLUXBABHJQVFMA-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 340.191 g/mol
Solvent CDCl3
Source File Reference UWSI16029