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1,1,1,3,3-Pentachloro-4-(4-tolyl)-butane

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1,1,1,3,3-Pentachloro-4-(4-tolyl)-butane
SpectraBase Compound ID 91OEVaguuvM
InChI InChI=1S/C11H11Cl5/c1-8-2-4-9(5-3-8)6-10(12,13)7-11(14,15)16/h2-5H,6-7H2,1H3
InChIKey CWEJEKWJFZSZCO-UHFFFAOYSA-N
Mol Weight 320.5 g/mol
Molecular Formula C11H11Cl5
Exact Mass 317.930339 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7gGB4QASxS0
Name 1,1,1,3,3-Pentachloro-4-(4-tolyl)-butane
CAS Registry Number 64960-10-7
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H11Cl5
InChI InChI=1S/C11H11Cl5/c1-8-2-4-9(5-3-8)6-10(12,13)7-11(14,15)16/h2-5H,6-7H2,1H3
InChIKey CWEJEKWJFZSZCO-UHFFFAOYSA-N
Instrument Name Bruker HX-90
Literature Reference R.K. Freidlina, V.I. Dostovalova, Org. Magn. Resonance 15, 133 (1981).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent Mixture