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3-{[(2Z)-3-Chloro-3-(4-chlorophenyl)prop-2-enoyl]amino}-2,2-dimethyl-3-oxopropanoic Acid
SpectraBase Compound ID Dd7kXTuk83K
InChI InChI=1S/C14H13Cl2NO4/c1-14(2,13(20)21)12(19)17-11(18)7-10(16)8-3-5-9(15)6-4-8/h3-7H,1-2H3,(H,20,21)(H,17,18,19)/b10-7-
InChIKey XSFQAVQMUXDDFI-YFHOEESVSA-N
Mol Weight 330.17 g/mol
Molecular Formula C14H13Cl2NO4
Exact Mass 329.022163 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2IidEu9bOoC
Name 3-{[(2Z)-3-Chloro-3-(4-chlorophenyl)prop-2-enoyl]amino}-2,2-dimethyl-3-oxopropanoic Acid
Alternate Name(s) (Z)-3-(3-chloro-3-(4-chlorophenyl)acrylamido)-2,2-dimethyl-3-oxopropanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H13Cl2NO4
InChI InChI=1S/C14H13Cl2NO4/c1-14(2,13(20)21)12(19)17-11(18)7-10(16)8-3-5-9(15)6-4-8/h3-7H,1-2H3,(H,20,21)(H,17,18,19)/b10-7-
InChIKey XSFQAVQMUXDDFI-YFHOEESVSA-N
Molecular Weight 330.167 g/mol
SMILES N(C(C(C(=O)O)(C)C)=O)C(\C=C\(c1ccc(cc1)Cl)Cl)=O
SPLASH splash10-0ue9-1960000000-0c2e4de2c9d736acc7d9
Source of Spectrum F4-45-808-12b
Wiley ID 1737111