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1,7-Bis(4-methoxy-2,3,5,6-Tetrafluorophenyl)-1,6-heptadiyne
SpectraBase Compound ID LZSxID0ryLo
InChI InChI=1S/C21H12F8O2/c1-30-20-16(26)12(22)10(13(23)17(20)27)8-6-4-3-5-7-9-11-14(24)18(28)21(31-2)19(29)15(11)25/h3-5H2,1-2H3
InChIKey KFFVOJOFZSTZCK-UHFFFAOYSA-N
Mol Weight 448.31 g/mol
Molecular Formula C21H12F8O2
Exact Mass 448.070955 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LIOrllEjClK
Name 1,7-BIS-(4-METHOXY-2,3,5,6-TETRAFLUOROPHENYL)-1,6-HEPTADIYNE
Compound Number 20A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H12F8O2
InChI InChI=1S/C21H12F8O2/c1-30-20-16(26)12(22)10(13(23)17(20)27)8-6-4-3-5-7-9-11-14(24)18(28)21(31-2)19(29)15(11)25/h3-5H2,1-2H3
InChIKey KFFVOJOFZSTZCK-UHFFFAOYSA-N
Literature Reference Author B.V.NGUYEN,Z.Y.YANG,D.J.BURTON
Literature Reference Citation J.ORG.CHEM.,58,7368(1993)
Literature Reference DOI 10.1021/jo00078a013
Molecular Weight 448.312 g/mol
Solvent CDCl3
Source File Reference UWMZ2366