(2S)-2-[(4-aminobenzoyl)amino]glutaric acid

SpectraBase Compound ID	CbHVUrAtQtZ
InChI	InChI=1S/C12H14N2O5/c13-8-3-1-7(2-4-8)11(17)14-9(12(18)19)5-6-10(15)16/h1-4,9H,5-6,13H2,(H,14,17)(H,15,16)(H,18,19)/t9-/m0/s1/i1+1,2+1,3+1,4+1,7+1,8+1
InChIKey	GADGMZDHLQLZRI-OAGKVIAZSA-N Google Search
Mol Weight	272.21 g/mol
Molecular Formula	C613C6H14N2O5
Exact Mass	272.110401 g/mol

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SpectraBase Spectrum ID	702aQyMsWAa
Name	(2S)-2-[(4-aminobenzoyl)amino]glutaric acid
Alternate Name(s)	(2S)-2-[(4-aminobenzoyl)amino]pentanedioic acid (2S)-2-[(4-azanylphenyl)carbonylamino]pentanedioic acid (2S)-2-[[(4-aminophenyl)-oxomethyl]amino]pentanedioic acid
Comments	Original formula: C6[13C]6H14N2O5
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Formula	C12H14N2O5
InChI	InChI=1S/C12H14N2O5/c13-8-3-1-7(2-4-8)11(17)14-9(12(18)19)5-6-10(15)16/h1-4,9H,5-6,13H2,(H,14,17)(H,15,16)(H,18,19)/t9-/m0/s1/i1+1,2+1,3+1,4+1,7+1,8+1
InChIKey	GADGMZDHLQLZRI-OAGKVIAZSA-N
Molecular Weight	272.207 g/mol
SMILES	[13cH]1[13cH][13c]([13cH][13cH][13c]1C(N[C@@](CCC(=O)O)(C(=O)O)[H])=O)N
SPLASH	splash10-004l-0930000000-8684a6e839661ea64842
Source of Spectrum	KC-0-1320-23
Wiley ID	827974