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3-{[(2Z)-3-Chloro-3-phenylprop-2-enoyl]amino}-2,2-dimethyl-3-oxopropanoic Acid
SpectraBase Compound ID Hgr3PoyTIgE
InChI InChI=1S/C14H14ClNO4/c1-14(2,13(19)20)12(18)16-11(17)8-10(15)9-6-4-3-5-7-9/h3-8H,1-2H3,(H,19,20)(H,16,17,18)/b10-8-
InChIKey MKZKRNZVTTYKJU-NTMALXAHSA-N
Mol Weight 295.72 g/mol
Molecular Formula C14H14ClNO4
Exact Mass 295.061136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HQmpqrXEljj
Name 3-{[(2Z)-3-Chloro-3-phenylprop-2-enoyl]amino}-2,2-dimethyl-3-oxopropanoic Acid
Alternate Name(s) (Z)-3-(3-chloro-3-phenylacrylamido)-2,2-dimethyl-3-oxopropanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14ClNO4
InChI InChI=1S/C14H14ClNO4/c1-14(2,13(19)20)12(18)16-11(17)8-10(15)9-6-4-3-5-7-9/h3-8H,1-2H3,(H,19,20)(H,16,17,18)/b10-8-
InChIKey MKZKRNZVTTYKJU-NTMALXAHSA-N
Molecular Weight 295.722 g/mol
SMILES N(C(C(C(=O)O)(C)C)=O)C(\C=C\(c1ccccc1)Cl)=O
SPLASH splash10-014i-0960000000-6e36f27b25c606aaecad
Source of Spectrum F4-45-808-12a
Wiley ID 1737112