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4,4,9,9-TETRACHLOROUNDECACYCLO-[9.9.0.0(1,5).0(2,12).0(2,18).0(3,7).0(6,10).0(8,12).0(11,15).0(13,17).0(16,20)]-ICOSANE
SpectraBase Compound ID QyR1t70Nt6
InChI InChI=1S/C20H16Cl4/c21-19(22)11-9-10-12(19)16-4-1-3-7-5-2-6(8(4)7)18(16)14(10)20(23,24)13(9)17(5,18)15(3,11)16/h3-14H,1-2H2
InChIKey LNVDSDFTYAHVSV-UHFFFAOYSA-N
Mol Weight 398.2 g/mol
Molecular Formula C20H16Cl4
Exact Mass 396.000611 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Dn0iSiC49m3
Name 4,4,9,9-TETRACHLOROUNDECACYCLO-[9.9.0.0(1,5).0(2,12).0(2,18).0(3,7).0(6,10).0(8,12).0(11,15).0(13,17).0(16,20)]-ICOSANE
CAS Registry Number 140855-21-6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H16Cl4
InChI InChI=1S/C20H16Cl4/c21-19(22)11-9-10-12(19)16-4-1-3-7-5-2-6(8(4)7)18(16)14(10)20(23,24)13(9)17(5,18)15(3,11)16/h3-14H,1-2H2
InChIKey LNVDSDFTYAHVSV-UHFFFAOYSA-N
Literature Reference Author W.D.FESSNER,B.A.R.C.MURTY,P.R.SPURR,R.PINKOS,J.P.MELDER,H.FR ITZ,H.PRINZBACH
Literature Reference Citation CHEM.BER.,125,1697(1992)
Literature Reference DOI 10.1002/cber.19921250727
Molecular Weight 398.159 g/mol
Solvent CDCl3
Source File Reference UWCS8504