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Methyl (2S)-2-[(2-aminobenzoyl)amino]-3-methylbutanoate
SpectraBase Compound ID 5JQkGaHu1In
InChI InChI=1S/C13H18N2O3/c1-8(2)11(13(17)18-3)15-12(16)9-6-4-5-7-10(9)14/h4-8,11H,14H2,1-3H3,(H,15,16)/t11-/m0/s1
InChIKey BESOUTWBUBKRFG-NSHDSACASA-N
Mol Weight 250.3 g/mol
Molecular Formula C13H18N2O3
Exact Mass 250.131742 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L8eOwT8gOI9
Name Methyl (2S)-2-[(2-aminobenzoyl)amino]-3-methylbutanoate
Alternate Name(s) (2S)-2-[[(2-aminophenyl)-oxomethyl]amino]-3-methylbutanoic acid methyl ester Methyl (2S)-2-[(2-aminobenzoyl)amino]-3-methyl-butanoate Methyl (2S)-2-[(2-aminophenyl)carbonylamino]-3-methyl-butanoate
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Formula C13H18N2O3
InChI InChI=1S/C13H18N2O3/c1-8(2)11(13(17)18-3)15-12(16)9-6-4-5-7-10(9)14/h4-8,11H,14H2,1-3H3,(H,15,16)/t11-/m0/s1
InChIKey BESOUTWBUBKRFG-NSHDSACASA-N
Molecular Weight 250.298 g/mol
SMILES N(C(c1c(cccc1)N)=O)[C@](C(=O)OC)(C(C)C)[H]
SPLASH splash10-00di-2920000000-6f330e78e4f90357efa7
Source of Spectrum SK-30-151-4
Wiley ID 881048