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2-[2-(4-chlorophenyl)-2-keto-ethyl]malonic acid dimethyl ester
SpectraBase Compound ID IRBxSM9jFAp
InChI InChI=1S/C13H13ClO5/c1-18-12(16)10(13(17)19-2)7-11(15)8-3-5-9(14)6-4-8/h3-6,10H,7H2,1-2H3
InChIKey ZCLMAZVKDZCXLH-UHFFFAOYSA-N
Mol Weight 284.69 g/mol
Molecular Formula C13H13ClO5
Exact Mass 284.045151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7W6UPRZawp6
Name 2-[2-(4-chlorophenyl)-2-keto-ethyl]malonic acid dimethyl ester
Alternate Name(s) 2-[2-(4-chlorophenyl)-2-oxoethyl]propanedioic acid dimethyl ester Dimethyl 2-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]propanedioate Dimethyl 2-[2-(4-chlorophenyl)-2-oxo-ethyl]propanedioate
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Formula C13H13ClO5
InChI InChI=1S/C13H13ClO5/c1-18-12(16)10(13(17)19-2)7-11(15)8-3-5-9(14)6-4-8/h3-6,10H,7H2,1-2H3
InChIKey ZCLMAZVKDZCXLH-UHFFFAOYSA-N
Molecular Weight 284.695 g/mol
SMILES C(CC(c1ccc(cc1)Cl)=O)(C(=O)OC)C(=O)OC
SPLASH splash10-001i-0920000000-c5f31f2c7340d93931ce
Source of Spectrum SK-27-3056-3
Wiley ID 868066