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3-(5-CHLORODECAFLUOROPENTYL)-4,5,6,7-TETRAHYDROINDAZOLE

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3-(5-CHLORODECAFLUOROPENTYL)-4,5,6,7-TETRAHYDROINDAZOLE
SpectraBase Compound ID 2bUeq71sOV4
InChI InChI=1S/C12H9ClF10N2/c13-12(22,23)11(20,21)10(18,19)9(16,17)8(14,15)7-5-3-1-2-4-6(5)24-25-7/h1-4H2,(H,24,25)
InChIKey MRXSJLHUKDCBSD-UHFFFAOYSA-N
Mol Weight 406.66 g/mol
Molecular Formula C12H9ClF10N2
Exact Mass 406.029458 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JDXlwAD5D0u
Name 3-(5-CHLORODECAFLUOROPENTYL)-4,5,6,7-TETRAHYDROINDAZOLE
Compound Number 4AF
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H9ClF10N2
InChI InChI=1S/C12H9ClF10N2/c13-12(22,23)11(20,21)10(18,19)9(16,17)8(14,15)7-5-3-1-2-4-6(5)24-25-7/h1-4H2,(H,24,25)
InChIKey MRXSJLHUKDCBSD-UHFFFAOYSA-N
Literature Reference Author X.Q.TANG,C.M.HU
Literature Reference Citation J.CHEM.SOC.PERKIN-1,1039(1995)
Literature Reference DOI 10.1039/p19950001039
Solvent ACETONE-D6
Source File Reference UWMZ3960