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1,1,1,3,3-Pentachloro-4-(4-nitrophenyl)-butane
SpectraBase Compound ID 9m2rzsur3w2
InChI InChI=1S/C10H8Cl5NO2/c11-9(12,6-10(13,14)15)5-7-1-3-8(4-2-7)16(17)18/h1-4H,5-6H2
InChIKey USEBEYJDYHPMTI-UHFFFAOYSA-N
Mol Weight 351.4 g/mol
Molecular Formula C10H8Cl5NO2
Exact Mass 348.899767 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6xT1rc04YvD
Name 1,1,1,3,3-Pentachloro-4-(4-nitrophenyl)-butane
CAS Registry Number 64960-11-8
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C10H8Cl5NO2
InChI InChI=1S/C10H8Cl5NO2/c11-9(12,6-10(13,14)15)5-7-1-3-8(4-2-7)16(17)18/h1-4H,5-6H2
InChIKey USEBEYJDYHPMTI-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