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Acetamide, N-1,3-butadienyl-2,2,2-trichloro-, (E)-

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Acetamide, N-1,3-butadienyl-2,2,2-trichloro-, (E)-
SpectraBase Compound ID 4gkeKy3eZ65
InChI InChI=1S/C6H6Cl3NO/c1-2-3-4-10-5(11)6(7,8)9/h2-4H,1H2,(H,10,11)/b4-3+
InChIKey FLOXTSQLOVXMGY-ONEGZZNKSA-N
Mol Weight 214.48 g/mol
Molecular Formula C6H6Cl3NO
Exact Mass 212.951497 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Cl8xyEJSoso
Name (E)-2,2,2-Trichloro-N-(1,3-butadienyl)-acetamide
CAS Registry Number 59403-01-9
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C6H6Cl3NO
InChI InChI=1S/C6H6Cl3NO/c1-2-3-4-10-5(11)6(7,8)9/h2-4H,1H2,(H,10,11)/b4-3+
InChIKey FLOXTSQLOVXMGY-ONEGZZNKSA-N
Instrument Name Bruker WH-90
Literature Reference L.E. Overman, L.A. Clizbe, R.L. Freerks, J. Am. Chem. Soc. 103, 2807 (1981).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3