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N-(2-Carboxyethyl)iminodiacetic acid

View entire compound with spectra: 1 FTIR

N-(2-Carboxyethyl)iminodiacetic acid
SpectraBase Compound ID EMSQ3UXFfj6
InChI InChI=1S/C7H11NO6/c9-5(10)1-2-8(3-6(11)12)4-7(13)14/h1-4H2,(H,9,10)(H,11,12)(H,13,14)
InChIKey UWRBFYBQPCJRRL-UHFFFAOYSA-N
Mol Weight 205.17 g/mol
Molecular Formula C7H11NO6
Exact Mass 205.058637 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID JPLSwCzqSIL
Name N-(2-Carboxyethyl)iminodiacetic acid
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 205.058637072 u
Formula C7H11NO6
InChI InChI=1S/C7H11NO6/c9-5(10)1-2-8(3-6(11)12)4-7(13)14/h1-4H2,(H,9,10)(H,11,12)(H,13,14)
InChIKey UWRBFYBQPCJRRL-UHFFFAOYSA-N
Molecular Weight 205.166 g/mol
SMILES C(O)(=O)CN(CCC(=O)O)CC(=O)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.905853