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2-([(3-Carboxypropyl)amino]carbonyl)benzoic acid

View entire compound with spectra: 3 MS (GC)

2-([(3-Carboxypropyl)amino]carbonyl)benzoic acid
SpectraBase Compound ID BDkZYbdsHxk
InChI InChI=1S/C12H13NO5/c14-10(15)6-3-7-13-11(16)8-4-1-2-5-9(8)12(17)18/h1-2,4-5H,3,6-7H2,(H,13,16)(H,14,15)(H,17,18)
InChIKey LENIZMSGCFPTBO-UHFFFAOYSA-N
Mol Weight 251.24 g/mol
Molecular Formula C12H13NO5
Exact Mass 251.079373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 43jXX6ypJjp
Name 4-(2-CARBOXYBENZAMIDO)BUTYRIC ACID
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H13NO5
InChI InChI=1S/C12H13NO5/c14-10(15)6-3-7-13-11(16)8-4-1-2-5-9(8)12(17)18/h1-2,4-5H,3,6-7H2,(H,13,16)(H,14,15)(H,17,18)
InChIKey LENIZMSGCFPTBO-UHFFFAOYSA-N
Molecular Weight 251.0790
SMILES N(CCCC(O)=O)C(c1c(C(O)=O)cccc1)=O
SPLASH splash10-0it9-5900000000-8afca330f6f3694a8772
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany