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(R)-Ethyl 3-(2-chloroethanamido)-2-(3,4-dichlorophenyl)-2-hydroxypropanoate
SpectraBase Compound ID CifH5CG6xiO
InChI InChI=1S/C13H14Cl3NO4/c1-2-21-12(19)13(20,7-17-11(18)6-14)8-3-4-9(15)10(16)5-8/h3-5,20H,2,6-7H2,1H3,(H,17,18)/t13-/m0/s1
InChIKey LRHYBUMAIMDJJV-ZDUSSCGKSA-N
Mol Weight 354.62 g/mol
Molecular Formula C13H14Cl3NO4
Exact Mass 352.998841 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FAjpMmg9Sq6
Name (R)-Ethyl 3-(2-chloroethanamido)-2-(3,4-dichlorophenyl)-2-hydroxypropanoate
Alternate Name(s) (R)-ethyl 3-(2-chloroacetamido)-2-(3,4-dichlorophenyl)-2-hydroxypropanoate (2R)-3-[(2-chloro-1-oxoethyl)amino]-2-(3,4-dichlorophenyl)-2-hydroxypropanoic acid ethyl ester Ethyl (2R)-3-[(2-chloroacetyl)amino]-2-(3,4-dichlorophenyl)-2-hydroxypropanoate Ethyl (2R)-3-[(2-chloroacetyl)amino]-2-(3,4-dichlorophenyl)-2-hydroxy-propanoate Ethyl (2R)-3-(2-chloranylethanoylamino)-2-(3,4-dichlorophenyl)-2-oxidanyl-propanoate
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Formula C13H14Cl3NO4
InChI InChI=1S/C13H14Cl3NO4/c1-2-21-12(19)13(20,7-17-11(18)6-14)8-3-4-9(15)10(16)5-8/h3-5,20H,2,6-7H2,1H3,(H,17,18)/t13-/m0/s1
InChIKey LRHYBUMAIMDJJV-ZDUSSCGKSA-N
Literature Reference DOI 10.1021/ol101555g
Molecular Weight 354.617 g/mol
SMILES N(C[C@](c1ccc(c(Cl)c1)Cl)(C(OCC)=O)O)C(=O)CCl
SPLASH splash10-05i0-0940000000-ea2bc6935b3e8116eccf
Source of Spectrum A1-12-3693/SM5-6
Wiley ID 1752473