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3-(Methoxycarbonyl)-3-methyl-2-(phenylamino)butanoic acid
SpectraBase Compound ID 1FoaVcLamph
InChI InChI=1S/C13H17NO4/c1-13(2,12(17)18-3)10(11(15)16)14-9-7-5-4-6-8-9/h4-8,10,14H,1-3H3,(H,15,16)
InChIKey MGFCFDXSYRBWEG-UHFFFAOYSA-N
Mol Weight 251.28 g/mol
Molecular Formula C13H17NO4
Exact Mass 251.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID MT5mg0eybe
Name 3-(Methoxycarbonyl)-3-methyl-2-(phenylamino)butanoic acid
Alternate Name(s) 2-Anilino-4-methoxy-3,3-dimethyl-4-oxobutanoic acid
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Formula C13H17NO4
InChI InChI=1S/C13H17NO4/c1-13(2,12(17)18-3)10(11(15)16)14-9-7-5-4-6-8-9/h4-8,10,14H,1-3H3,(H,15,16)
InChIKey MGFCFDXSYRBWEG-UHFFFAOYSA-N
Molecular Weight 251.282 g/mol
SMILES N(C(C(=O)O)C(C)(C)C(=O)OC)c1ccccc1
SPLASH splash10-0h00-6910000000-291566c148c327b13c72
Source of Spectrum F-56-3232-1
Wiley ID 856938