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(E)-3-amino-3-chloro-2-cyano-acrylic acid 2,2,2-trichloroethyl ester
SpectraBase Compound ID 2duIJ7PAkn3
InChI InChI=1S/C6H4Cl4N2O2/c7-4(12)3(1-11)5(13)14-2-6(8,9)10/h2,12H2/b4-3-
InChIKey PGFNWMFWVWFHIR-ARJAWSKDSA-N
Mol Weight 277.9 g/mol
Molecular Formula C6H4Cl4N2O2
Exact Mass 275.902688 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4zzXLKo1y5l
Name (E)-3-amino-3-chloro-2-cyano-2-propenoic acid 2,2,2-trichloroethyl ester
Alternate Name(s) (E)-3-amino-3-chloro-2-cyano-acrylic acid 2,2,2-trichloroethyl ester 2,2,2-trichloroethyl (E)-3-amino-3-chloro-2-cyano-prop-2-enoate 2,2,2-tris(chloranyl)ethyl (E)-3-azanyl-3-chloranyl-2-cyano-prop-2-enoate
CAS Registry Number 114907-75-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H4Cl4N2O2
InChI InChI=1S/C6H4Cl4N2O2/c7-4(12)3(1-11)5(13)14-2-6(8,9)10/h2,12H2/b4-3-
InChIKey PGFNWMFWVWFHIR-ARJAWSKDSA-N
Molecular Weight 277.922 g/mol
SMILES N\C(=C/(C(OCC(Cl)(Cl)Cl)=O)C#N)Cl
SPLASH splash10-004i-0920000000-2d71c3bfd194c0d8b715
Source of Spectrum K-121-1819-2
Wiley ID 1279411