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11,11-DICHLOROUNDECACYCLO-[13.10.0(1,21).0(2,6).0(4,12).0(5,9).0(7,21).0(10,12).0(10,18).0(13,17).0(16,20)]-PENTACOSANE
SpectraBase Compound ID CpBTZusqkAE
InChI InChI=1S/C25H28Cl2/c26-25(27)23-13-5-9-17-11-7-15(19(13)17)24(23,25)16-8-12-18-10(6-14(23)20(16)18)21(9)3-1-2-4-22(11,12)21/h9-20H,1-8H2
InChIKey WHQKLIMKSGTXGL-UHFFFAOYSA-N
Mol Weight 399.41 g/mol
Molecular Formula C25H28Cl2
Exact Mass 398.156806 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LYGikJK6M1X
Name 11,11-DICHLOROUNDECACYCLO-[13.10.0(1,21).0(2,6).0(4,12).0(5,9).0(7,21).0(10,12).0(10,18).0(13,17).0(16,20)]-PENTACOSANE
CAS Registry Number 140901-54-8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H28Cl2
InChI InChI=1S/C25H28Cl2/c26-25(27)23-13-5-9-17-11-7-15(19(13)17)24(23,25)16-8-12-18-10(6-14(23)20(16)18)21(9)3-1-2-4-22(11,12)21/h9-20H,1-8H2
InChIKey WHQKLIMKSGTXGL-UHFFFAOYSA-N
Literature Reference Author B.A.R.C.MURTY,R.PINKOS,P.R.SPURR,W.D.FESSNER,G.LUTZ,H.FRITZ, D.HUNKLER,H.PRINZBAC
Literature Reference Citation CHEM.BER.,125,1719(1992)
Literature Reference DOI 10.1002/cber.19921250728
Molecular Weight 399.403 g/mol
Solvent CDCl3
Source File Reference UWCS8462