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N-(phenylacetyl)-3-(4-propoxyphenyl)-beta-alanine
SpectraBase Compound ID 8sdhbfuSi0Y
InChI InChI=1S/C20H23NO4/c1-2-12-25-17-10-8-16(9-11-17)18(14-20(23)24)21-19(22)13-15-6-4-3-5-7-15/h3-11,18H,2,12-14H2,1H3,(H,21,22)(H,23,24)
InChIKey AVOYRGCOYDNSKD-UHFFFAOYSA-N
Mol Weight 341.41 g/mol
Molecular Formula C20H23NO4
Exact Mass 341.162708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9ftClS1ADnh
Name 3-(2-phenylethanoylamino)-3-(4-propoxyphenyl)propanoic acid
Alternate Name(s) 3-[(1-oxo-2-phenylethyl)amino]-3-(4-propoxyphenyl)propanoic acid 3-[(2-phenylacetyl)amino]-3-(4-propoxyphenyl)propanoic acid 3-[(2-phenylacetyl)amino]-3-(4-propoxyphenyl)propionic acid
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Formula C20H23NO4
InChI InChI=1S/C20H23NO4/c1-2-12-25-17-10-8-16(9-11-17)18(14-20(23)24)21-19(22)13-15-6-4-3-5-7-15/h3-11,18H,2,12-14H2,1H3,(H,21,22)(H,23,24)
InChIKey AVOYRGCOYDNSKD-UHFFFAOYSA-N
Molecular Weight 341.407 g/mol
SMILES N(C(=O)Cc1ccccc1)C(CC(=O)O)c1ccc(cc1)OCCC
SPLASH splash10-006x-9830000000-ea017442beceecd784bb
Wiley ID 1443741