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4,4,6-Trichloro-hexanenitrile

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4,4,6-Trichloro-hexanenitrile
SpectraBase Compound ID 4ab1V0FMdeR
InChI InChI=1S/C6H8Cl3N/c7-4-3-6(8,9)2-1-5-10/h1-4H2
InChIKey QYXNBGLLEUSUBO-UHFFFAOYSA-N
Mol Weight 200.5 g/mol
Molecular Formula C6H8Cl3N
Exact Mass 198.972232 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DZENmgHJCJZ
Name 4,4,6-Trichloro-hexanenitrile
CAS Registry Number 36678-10-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C6H8Cl3N
InChI InChI=1S/C6H8Cl3N/c7-4-3-6(8,9)2-1-5-10/h1-4H2
InChIKey QYXNBGLLEUSUBO-UHFFFAOYSA-N
Instrument Name Bruker HX-90
Literature Reference F.K. Velichko, E.C. Chukovskaya, Org. Magn. Resonance 7, 361 (1975.
NMR Standard CHCl3
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent Neat liquid