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Benzeneacetic acid, 2,4-dichloro-.alpha.-hydroxy-, ethyl ester
SpectraBase Compound ID 5Cc8twJHVEr
InChI InChI=1S/C10H10Cl2O3/c1-2-15-10(14)9(13)7-4-3-6(11)5-8(7)12/h3-5,9,13H,2H2,1H3/t9-/m0/s1
InChIKey ZXVBKKZCEISQNC-VIFPVBQESA-N
Mol Weight 249.09 g/mol
Molecular Formula C10H10Cl2O3
Exact Mass 248.0007 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B21LOA3jVMe
Name Benzeneacetic acid, 2,4-dichloro-.alpha.-hydroxy-, ethyl ester
Alternate Name(s) Mandelic acid, 2,4-dichloro-, ethyl ester Ethyl (2S)-(2,4-dichlorophenyl)(hydroxy)ethanoate Ethyl (S)-(+)-2-hydroxy-2-(2',4'-dichlorophenyl)acetate (2S)-2-(2,4-dichlorophenyl)-2-hydroxyacetic acid ethyl ester Ethyl (2S)-2-(2,4-dichlorophenyl)-2-hydroxyacetate Ethyl (2S)-2-(2,4-dichlorophenyl)-2-hydroxy-acetate Ethyl (2S)-2-(2,4-dichlorophenyl)-2-oxidanyl-ethanoate
CAS Registry Number 41204-18-6
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Formula C10H10Cl2O3
InChI InChI=1S/C10H10Cl2O3/c1-2-15-10(14)9(13)7-4-3-6(11)5-8(7)12/h3-5,9,13H,2H2,1H3/t9-/m0/s1
InChIKey ZXVBKKZCEISQNC-VIFPVBQESA-N
Molecular Weight 249.093 g/mol
SMILES O[C@@](c1c(cc(cc1)Cl)Cl)(C(=O)OCC)[H]
SPLASH splash10-004i-0920000000-9b404666f3b810628337
Source of Spectrum QC-8-1094-6
Wiley ID 869897