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3-PERFLUOROBUTYL-4,5,6,7-TETRAHYDRO-2-PHENYL-2H-INDAZOLE
SpectraBase Compound ID FDJn8ZwA8d3
InChI InChI=1S/C17H13F9N2/c18-14(19,15(20,21)16(22,23)17(24,25)26)13-11-8-4-5-9-12(11)27-28(13)10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9H2
InChIKey UTRBEZJNUHDYSD-UHFFFAOYSA-N
Mol Weight 416.29 g/mol
Molecular Formula C17H13F9N2
Exact Mass 416.093502 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7k8Tu7PoBE
Name 3-PERFLUOROBUTYL-4,5,6,7-TETRAHYDRO-2-PHENYL-2H-INDAZOLE
Compound Number 5D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H13F9N2
InChI InChI=1S/C17H13F9N2/c18-14(19,15(20,21)16(22,23)17(24,25)26)13-11-8-4-5-9-12(11)27-28(13)10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9H2
InChIKey UTRBEZJNUHDYSD-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 416.289 g/mol
Solvent CDCl3
Source File Reference UWSI16033