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3-Amino-3-(3-methoxy-4-propan-2-yloxyphenyl)propanoic acid
SpectraBase Compound ID F06FAvQGdZi
InChI InChI=1S/C13H19NO4/c1-8(2)18-11-5-4-9(6-12(11)17-3)10(14)7-13(15)16/h4-6,8,10H,7,14H2,1-3H3,(H,15,16)
InChIKey VJANWWLOYWLUTK-UHFFFAOYSA-N
Mol Weight 253.3 g/mol
Molecular Formula C13H19NO4
Exact Mass 253.131408 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C1r8vf9SMtm
Name 3-Amino-3-(3-methoxy-4-propan-2-yloxyphenyl)propanoic acid
Alternate Name(s) 3-Amino-3-(4-isopropoxy-3-methoxy-phenyl)propanoic acid 3-Amino-3-(4-isopropoxy-3-methoxy-phenyl)propionic acid 3-Ammonio-3-(3-methoxy-4-propan-2-yloxyphenyl)propanoate 3-Ammonio-3-(4-isopropoxy-3-methoxy-phenyl)propionate 3-Azaniumyl-3-(3-methoxy-4-propan-2-yloxy-phenyl)propanoate 3-Azaniumyl-3-(4-isopropoxy-3-methoxy-phenyl)propanoate 3-Azanyl-3-(3-methoxy-4-propan-2-yloxy-phenyl)propanoic acid
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Formula C13H19NO4
InChI InChI=1S/C13H19NO4/c1-8(2)18-11-5-4-9(6-12(11)17-3)10(14)7-13(15)16/h4-6,8,10H,7,14H2,1-3H3,(H,15,16)
InChIKey VJANWWLOYWLUTK-UHFFFAOYSA-N
Molecular Weight 253.298 g/mol
SMILES OC(CC(c1cc(OC)c(cc1)OC(C)C)N)=O
SPLASH splash10-0f6x-9800000000-a08fc2ce2e334292dbee
Wiley ID 1466164