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2-[acetyl(benzyl)amino]propanoic acid
SpectraBase Compound ID 4ZByNG1Ily3
InChI InChI=1S/C12H15NO3/c1-9(12(15)16)13(10(2)14)8-11-6-4-3-5-7-11/h3-7,9H,8H2,1-2H3,(H,15,16)
InChIKey BWNUBNZDOXXPOX-UHFFFAOYSA-N
Mol Weight 221.26 g/mol
Molecular Formula C12H15NO3
Exact Mass 221.105193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4siypquUJBK
Name 2-[acetyl(benzyl)amino]propanoic acid
Comments Less than 3 mono-isotopic peaks
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Formula C12H15NO3
InChI InChI=1S/C12H15NO3/c1-9(12(15)16)13(10(2)14)8-11-6-4-3-5-7-11/h3-7,9H,8H2,1-2H3,(H,15,16)
InChIKey BWNUBNZDOXXPOX-UHFFFAOYSA-N
Molecular Weight 221.256 g/mol
SMILES OC(C(N(C(=O)C)Cc1ccccc1)C)=O
SPLASH splash10-0006-9000000000-0cdb4425d6d6b107d5bc
Source of Spectrum H1-45-2189-1
Synonyms 2-[acetyl(benzyl)amino]propionic acid 2-[acetyl-(phenylmethyl)amino]propanoic acid 2-[ethanoyl-(phenylmethyl)amino]propanoic acid
Wiley ID 815914