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3-(3,4-dimethoxyphenyl)-3-[2-(2,5-dimethylphenoxy)ethanoylamino]propanoic acid
SpectraBase Compound ID 8lw8vnfRES7
InChI InChI=1S/C21H25NO6/c1-13-5-6-14(2)18(9-13)28-12-20(23)22-16(11-21(24)25)15-7-8-17(26-3)19(10-15)27-4/h5-10,16H,11-12H2,1-4H3,(H,22,23)(H,24,25)
InChIKey AVBYSDWWDHLWOY-UHFFFAOYSA-N
Mol Weight 387.43 g/mol
Molecular Formula C21H25NO6
Exact Mass 387.168188 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7Jd9OgM5UCc
Name 3-(3,4-dimethoxyphenyl)-3-[2-(2,5-dimethylphenoxy)ethanoylamino]propanoic acid
Alternate Name(s) 3-(3,4-dimethoxyphenyl)-3-[[2-(2,5-dimethylphenoxy)-1-oxoethyl]amino]propanoic acid 3-(3,4-dimethoxyphenyl)-3-[[2-(2,5-dimethylphenoxy)acetyl]amino]propanoic acid
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Formula C21H25NO6
InChI InChI=1S/C21H25NO6/c1-13-5-6-14(2)18(9-13)28-12-20(23)22-16(11-21(24)25)15-7-8-17(26-3)19(10-15)27-4/h5-10,16H,11-12H2,1-4H3,(H,22,23)(H,24,25)
InChIKey AVBYSDWWDHLWOY-UHFFFAOYSA-N
Molecular Weight 387.432 g/mol
SMILES N(C(CC(O)=O)c1cc(c(cc1)OC)OC)C(=O)COc1c(ccc(c1)C)C
SPLASH splash10-05di-7930000000-795a8bb84b67d3955cf2
Wiley ID 1445800