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Methyl 5-(2'-aminobenzoyl)-2-oxopentanoate
SpectraBase Compound ID CsyFU1v4KJl
InChI InChI=1S/C13H15NO4/c1-18-13(17)12(16)8-4-7-11(15)9-5-2-3-6-10(9)14/h2-3,5-6H,4,7-8,14H2,1H3
InChIKey JXZBLKTZMCFGMC-UHFFFAOYSA-N
Mol Weight 249.27 g/mol
Molecular Formula C13H15NO4
Exact Mass 249.100108 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DM2N4EHzqau
Name Methyl 5-(2'-aminobenzoyl)-2-oxopentanoate
Alternate Name(s) Methyl 6-(2-aminophenyl)-2,6-dioxohexanoate
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Formula C13H15NO4
InChI InChI=1S/C13H15NO4/c1-18-13(17)12(16)8-4-7-11(15)9-5-2-3-6-10(9)14/h2-3,5-6H,4,7-8,14H2,1H3
InChIKey JXZBLKTZMCFGMC-UHFFFAOYSA-N
Molecular Weight 249.266 g/mol
SMILES Nc1c(C(=O)CCCC(C(=O)OC)=O)cccc1
SPLASH splash10-00dm-3920000000-9a06a9fe5b3d3013c77d
Source of Spectrum ES-30-580-2
Wiley ID 813443