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3-[5-(2,4-Dichloro-benzylamino)-3-(2-methoxycarbonyl-ethyl)-2,6-dioxo-3,6-dihydro-2H-pyrimidin-1-yl]-propionic acid methyl ester
SpectraBase Compound ID GVlbzSsXfdO
InChI InChI=1S/C19H21Cl2N3O6/c1-29-16(25)5-7-23-11-15(22-10-12-3-4-13(20)9-14(12)21)18(27)24(19(23)28)8-6-17(26)30-2/h3-4,9,11,22H,5-8,10H2,1-2H3
InChIKey FFNFAOAGXIBUIQ-UHFFFAOYSA-N
Mol Weight 458.3 g/mol
Molecular Formula C19H21Cl2N3O6
Exact Mass 457.080741 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JKYdxF9NOTF
Name 3-[5-(2,4-Dichloro-benzylamino)-3-(2-methoxycarbonyl-ethyl)-2,6-dioxo-3,6-dihydro-2H-pyrimidin-1-yl]-propionic acid methyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C19H21Cl2N3O6
InChI InChI=1S/C19H21Cl2N3O6/c1-29-16(25)5-7-23-11-15(22-10-12-3-4-13(20)9-14(12)21)18(27)24(19(23)28)8-6-17(26)30-2/h3-4,9,11,22H,5-8,10H2,1-2H3
InChIKey FFNFAOAGXIBUIQ-UHFFFAOYSA-N
Molecular Weight 458.298 g/mol
SMILES N(C=1C(N(C(N(CCC(=O)OC)C1)=O)CCC(=O)OC)=O)Cc1c(cc(cc1)Cl)Cl
SPLASH splash10-0bt9-0000900000-fffc3dc9cdd71a4f2cc5
Source of Spectrum F4-43-609-18c
Synonyms Dimethyl 3,3'-[5-(2,4-Dichlorobenzylamino)uracil-1,3-diyl]dipropanoate
Wiley ID 1675229