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3-Amino-3-(4-isopropoxyphenyl)propanoic acid
SpectraBase Compound ID KTsYLua04qd
InChI InChI=1S/C12H17NO3/c1-8(2)16-10-5-3-9(4-6-10)11(13)7-12(14)15/h3-6,8,11H,7,13H2,1-2H3,(H,14,15)
InChIKey GQJOHIGVBBGCRS-UHFFFAOYSA-N
Mol Weight 223.27 g/mol
Molecular Formula C12H17NO3
Exact Mass 223.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FIEBCrz1lQ7
Name 3-Amino-3-(4-isopropoxyphenyl)propanoic acid
Alternate Name(s) 3-Amino-3-(4-isopropoxyphenyl)propionic acid 3-Amino-3-(4-propan-2-yloxyphenyl)propanoic acid 3-Ammonio-3-(4-isopropoxyphenyl)propionate 3-Ammonio-3-(4-propan-2-yloxyphenyl)propanoate 3-Azaniumyl-3-(4-isopropoxyphenyl)propanoate 3-Azaniumyl-3-(4-propan-2-yloxyphenyl)propanoate 3-Azanyl-3-(4-propan-2-yloxyphenyl)propanoic acid
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Formula C12H17NO3
InChI InChI=1S/C12H17NO3/c1-8(2)16-10-5-3-9(4-6-10)11(13)7-12(14)15/h3-6,8,11H,7,13H2,1-2H3,(H,14,15)
InChIKey GQJOHIGVBBGCRS-UHFFFAOYSA-N
Molecular Weight 223.272 g/mol
SMILES NC(CC(=O)O)c1ccc(cc1)OC(C)C
SPLASH splash10-00di-7900000000-b21c28e95b4c0f34a460
Wiley ID 1450515