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2-[2-(carbethoxyamino)-4-chloro-benzoyl]malonic acid diethyl ester
SpectraBase Compound ID 84JQNH1kdo7
InChI InChI=1S/C17H20ClNO7/c1-4-24-15(21)13(16(22)25-5-2)14(20)11-8-7-10(18)9-12(11)19-17(23)26-6-3/h7-9,20H,4-6H2,1-3H3,(H,19,23)
InChIKey XKWYDBAGTYRDKB-UHFFFAOYSA-N
Mol Weight 385.8 g/mol
Molecular Formula C17H20ClNO7
Exact Mass 385.09283 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LQ0b22uXsdr
Name 2-[2-(carbethoxyamino)-4-chloro-benzoyl]malonic acid diethyl ester
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Formula C17H20ClNO7
InChI InChI=1S/C17H20ClNO7/c1-4-24-15(21)13(16(22)25-5-2)14(20)11-8-7-10(18)9-12(11)19-17(23)26-6-3/h7-9,20H,4-6H2,1-3H3,(H,19,23)
InChIKey XKWYDBAGTYRDKB-UHFFFAOYSA-N
Molecular Weight 385.800 g/mol
SMILES N(c1c(C(=C(C(=O)OCC)C(=O)OCC)O)ccc(c1)Cl)C(=O)OCC
SPLASH splash10-0089-0940000000-8698faa5f8435c4dfcf9
Source of Spectrum H1-51-1556-18
Synonyms 2-[[4-chloro-2-(ethoxycarbonylamino)phenyl]-oxomethyl]propanedioic acid diethyl ester Diethyl 2-[4-chloranyl-2-(ethoxycarbonylamino)phenyl]carbonylpropanedioate Diethyl 2-[4-chloro-2-(ethoxycarbonylamino)benzoyl]propanedioate
Wiley ID 817306