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HN-[[3,5-[(CF3)-(2)]-C6H3]-(2)]

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HN-[[3,5-[(CF3)-(2)]-C6H3]-(2)]
SpectraBase Compound ID 2PLJ0joXX4V
InChI InChI=1S/C16H7F12N/c17-13(18,19)7-1-8(14(20,21)22)4-11(3-7)29-12-5-9(15(23,24)25)2-10(6-12)16(26,27)28/h1-6,29H
InChIKey WTMZXARUPFXWQN-UHFFFAOYSA-N
Mol Weight 441.22 g/mol
Molecular Formula C16H7F12N
Exact Mass 441.038687 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4vCqUahjiKN
Name HN-[[3,5-[(CF3)-(2)]-C6H3]-(2)]
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H7F12N
InChI InChI=1S/C16H7F12N/c17-13(18,19)7-1-8(14(20,21)22)4-11(3-7)29-12-5-9(15(23,24)25)2-10(6-12)16(26,27)28/h1-6,29H
InChIKey WTMZXARUPFXWQN-UHFFFAOYSA-N
Literature Reference Author M.YAMASHITA,J.F.HARTWIG
Literature Reference Citation J.AM.CHEM.SOC.,126,5344(2004)
Literature Reference DOI 10.1021/ja0315107
Molecular Weight 441.219 g/mol
Solvent CDCl3
Source File Reference UWVN32001