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3-Amino-2-[benzyloxycarbonyl(methyl)amino]propanoic acid
SpectraBase Compound ID KMkLSM7WFBx
InChI InChI=1S/C12H16N2O4/c1-14(10(7-13)11(15)16)12(17)18-8-9-5-3-2-4-6-9/h2-6,10H,7-8,13H2,1H3,(H,15,16)
InChIKey LIUNHXJYXPEHPN-UHFFFAOYSA-N
Mol Weight 252.27 g/mol
Molecular Formula C12H16N2O4
Exact Mass 252.111007 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LxEcYtGbix8
Name 3-Amino-2-[benzyloxycarbonyl(methyl)amino]propanoic acid
Alternate Name(s) 3-Amino-2-[carbobenzoxy(methyl)amino]propionic acid 3-Amino-2-[methyl(phenylmethoxycarbonyl)amino]propanoic acid 3-Azanyl-2-[methyl(phenylmethoxycarbonyl)amino]propanoic acid
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Formula C12H16N2O4
InChI InChI=1S/C12H16N2O4/c1-14(10(7-13)11(15)16)12(17)18-8-9-5-3-2-4-6-9/h2-6,10H,7-8,13H2,1H3,(H,15,16)
InChIKey LIUNHXJYXPEHPN-UHFFFAOYSA-N
Molecular Weight 252.270 g/mol
SMILES NCC(C(=O)O)N(C)C(=O)OCc1ccccc1
SPLASH splash10-0006-9330000000-55619737ed856e2b88ab
Source of Spectrum U1-1998-781-15
Wiley ID 751066