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Ethylenediamine-N,N'-diacetic-N,N'-di-beta-propionic acid
SpectraBase Compound ID 3suSCedTmpJ
InChI InChI=1S/C12H20N2O8/c15-9(16)1-3-13(7-11(19)20)5-6-14(8-12(21)22)4-2-10(17)18/h1-8H2,(H,15,16)(H,17,18)(H,19,20)(H,21,22)
InChIKey IZQWNOQOAFSHOK-UHFFFAOYSA-N
Mol Weight 320.3 g/mol
Molecular Formula C12H20N2O8
Exact Mass 320.121966 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6O6Kwc6b3ie
Name Ethylenediamine-N,N'-diacetic acid-N,N'-di-.beta.-propionic acid
Alternate Name(s) Ethylenediamine-N,N'-diacetic-N,N'-dipropionic acid N,N'-Bis(2-carboxyethyl)-N,N'-ethylenediglycine 3-[2-[2-carboxyethyl(carboxymethyl)amino]ethyl-(carboxymethyl)amino]propanoic acid 3-[2-hydroxy-2-oxoethyl-[2-[2-hydroxy-2-oxoethyl(3-hydroxy-3-oxopropyl)amino]ethyl]amino]propanoic acid
CAS Registry Number 32701-19-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20N2O8
InChI InChI=1S/C12H20N2O8/c15-9(16)1-3-13(7-11(19)20)5-6-14(8-12(21)22)4-2-10(17)18/h1-8H2,(H,15,16)(H,17,18)(H,19,20)(H,21,22)
InChIKey IZQWNOQOAFSHOK-UHFFFAOYSA-N
Molecular Weight 320.298 g/mol
SMILES OC(CCN(CCN(CCC(O)=O)CC(O)=O)CC(=O)O)=O
SPLASH splash10-0a4l-9200000000-64d28c57b417223aa244
Source of Spectrum NP-11-1961-0
Wiley ID 1109437