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4-(2-chloroacetyl)benzonitrile

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4-(2-chloroacetyl)benzonitrile
SpectraBase Compound ID Hfr3XaBz4Px
InChI InChI=1S/C9H6ClNO/c10-5-9(12)8-3-1-7(6-11)2-4-8/h1-4H,5H2
InChIKey LDHNCFIXYHXVDN-UHFFFAOYSA-N
Mol Weight 179.61 g/mol
Molecular Formula C9H6ClNO
Exact Mass 179.013792 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C1hdmuPQuVt
Name 2-Chloro-4'-cyano-acetophenone
CAS Registry Number 40805-50-3
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H6ClNO
InChI InChI=1S/C9H6ClNO/c10-5-9(12)8-3-1-7(6-11)2-4-8/h1-4H,5H2
InChIKey LDHNCFIXYHXVDN-UHFFFAOYSA-N
Instrument Name Varian FT-80
Literature Reference P.R. Olivato, S.A. Guerrero, R. Rittner, Magn. Res. Chem. 25, 179 (1987).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3