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3-(4-isopropoxyphenyl)-3-(4-phenylbutanoylamino)propanoic acid
SpectraBase Compound ID 1Zn0amsrpR
InChI InChI=1S/C22H27NO4/c1-16(2)27-19-13-11-18(12-14-19)20(15-22(25)26)23-21(24)10-6-9-17-7-4-3-5-8-17/h3-5,7-8,11-14,16,20H,6,9-10,15H2,1-2H3,(H,23,24)(H,25,26)
InChIKey AYDTVZATYCOWPA-UHFFFAOYSA-N
Mol Weight 369.46 g/mol
Molecular Formula C22H27NO4
Exact Mass 369.194008 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Al1b5fd6iUj
Name 3-(4-isopropoxyphenyl)-3-(4-phenylbutanoylamino)propanoic acid
Alternate Name(s) 3-(4-isopropoxyphenyl)-3-(4-phenylbutanoylamino)propionic acid 3-(4-phenylbutanoylamino)-3-(4-propan-2-yloxyphenyl)propanoic acid 3-[(1-oxo-4-phenylbutyl)amino]-3-(4-propan-2-yloxyphenyl)propanoic acid
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Formula C22H27NO4
InChI InChI=1S/C22H27NO4/c1-16(2)27-19-13-11-18(12-14-19)20(15-22(25)26)23-21(24)10-6-9-17-7-4-3-5-8-17/h3-5,7-8,11-14,16,20H,6,9-10,15H2,1-2H3,(H,23,24)(H,25,26)
InChIKey AYDTVZATYCOWPA-UHFFFAOYSA-N
Molecular Weight 369.461 g/mol
SMILES OC(CC(c1ccc(cc1)OC(C)C)NC(=O)CCCc1ccccc1)=O
SPLASH splash10-006x-8920000000-a99c684e00927f2e59ea
Wiley ID 1444227