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2-[2-(3-chlorophenyl)-2-keto-ethyl]malonic acid dimethyl ester
SpectraBase Compound ID 8p1Vma2D8VY
InChI InChI=1S/C13H13ClO5/c1-18-12(16)10(13(17)19-2)7-11(15)8-4-3-5-9(14)6-8/h3-6,10H,7H2,1-2H3
InChIKey LQZNWTHYYRDKOL-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 8o302u6jNRU
Name 2-[2-(3-chlorophenyl)-2-keto-ethyl]malonic acid dimethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13ClO5
InChI InChI=1S/C13H13ClO5/c1-18-12(16)10(13(17)19-2)7-11(15)8-4-3-5-9(14)6-8/h3-6,10H,7H2,1-2H3
InChIKey LQZNWTHYYRDKOL-UHFFFAOYSA-N
Molecular Weight 284.695 g/mol
SMILES C(CC(c1cc(Cl)ccc1)=O)(C(=O)OC)C(=O)OC
SPLASH splash10-000i-0930000000-e3cbf97b4ca4d291d12f
Source of Spectrum SK-27-3057-3
Synonyms 2-[2-(3-chlorophenyl)-2-oxoethyl]propanedioic acid dimethyl ester Dimethyl 2-[2-(3-chlorophenyl)-2-oxidanylidene-ethyl]propanedioate Dimethyl 2-[2-(3-chlorophenyl)-2-oxo-ethyl]propanedioate
Wiley ID 868059