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(4,5-Dimethoxy-2-nitro-phenyl)-acetonitrile

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(4,5-Dimethoxy-2-nitro-phenyl)-acetonitrile
SpectraBase Compound ID F3vxsPDbgLO
InChI InChI=1S/C10H10N2O4/c1-15-9-5-7(3-4-11)8(12(13)14)6-10(9)16-2/h5-6H,3H2,1-2H3
InChIKey PKDJSFDIQCAPSY-UHFFFAOYSA-N
Mol Weight 222.2 g/mol
Molecular Formula C10H10N2O4
Exact Mass 222.064057 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5OnRwnrXJiH
Name (4,5-Dimethoxy-2-nitro-phenyl)-acetonitrile
CAS Registry Number 17354-04-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C10H10N2O4
InChI InChI=1S/C10H10N2O4/c1-15-9-5-7(3-4-11)8(12(13)14)6-10(9)16-2/h5-6H,3H2,1-2H3
InChIKey PKDJSFDIQCAPSY-UHFFFAOYSA-N
Literature Reference S. Sankaraman, W.A. Haney, J.K.Kochi, J. Am. Chem. Soc. 109, 5235 (1987).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3