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1,1,1-Trichloro-2-(4-tolyl)-ethane

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1,1,1-Trichloro-2-(4-tolyl)-ethane
SpectraBase Compound ID HJJzDReeLSS
InChI InChI=1S/C9H9Cl3/c1-7-2-4-8(5-3-7)6-9(10,11)12/h2-5H,6H2,1H3
InChIKey BGYCCIUNWPSLBB-UHFFFAOYSA-N
Mol Weight 223.53 g/mol
Molecular Formula C9H9Cl3
Exact Mass 221.976983 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Hq8hwUs7qxt
Name 1,1,1-Trichloro-2-(4-tolyl)-ethane
CAS Registry Number 2201-10-7
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H9Cl3
InChI InChI=1S/C9H9Cl3/c1-7-2-4-8(5-3-7)6-9(10,11)12/h2-5H,6H2,1H3
InChIKey BGYCCIUNWPSLBB-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