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

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1,1,1-Trichloro-2-(4-nitrophenyl)-ethane
SpectraBase Compound ID 8qsDfBG3LX1
InChI InChI=1S/C8H6Cl3NO2/c9-8(10,11)5-6-1-3-7(4-2-6)12(13)14/h1-4H,5H2
InChIKey GRXKQNJAZNVHAH-UHFFFAOYSA-N
Mol Weight 254.5 g/mol
Molecular Formula C8H6Cl3NO2
Exact Mass 252.946412 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LxZg1XlxMXY
Name 1,1,1-Trichloro-2-(4-nitrophenyl)-ethane
CAS Registry Number 2201-11-8
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C8H6Cl3NO2
InChI InChI=1S/C8H6Cl3NO2/c9-8(10,11)5-6-1-3-7(4-2-6)12(13)14/h1-4H,5H2
InChIKey GRXKQNJAZNVHAH-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