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Diethylenetriamine pentaacetic acid
SpectraBase Compound ID 5nSRZJYiEX0
InChI InChI=1S/C14H23N3O10/c18-10(19)5-15(1-3-16(6-11(20)21)7-12(22)23)2-4-17(8-13(24)25)9-14(26)27/h1-9H2,(H,18,19)(H,20,21)(H,22,23)(H,24,25)(H,26,27)
InChIKey QPCDCPDFJACHGM-UHFFFAOYSA-N
Mol Weight 393.35 g/mol
Molecular Formula C14H23N3O10
Exact Mass 393.138344 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JJ2EdOrOcgx
Name Diethylenetriaminepentaacetic acid
Alternate Name(s) 2,2',2'',2'''-((((carboxymethyl)azanediyl)bis(ethane-2,1-diyl))bis(azanetriyl))tetraacetic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H23N3O10
InChI InChI=1S/C14H23N3O10/c18-10(19)5-15(1-3-16(6-11(20)21)7-12(22)23)2-4-17(8-13(24)25)9-14(26)27/h1-9H2,(H,18,19)(H,20,21)(H,22,23)(H,24,25)(H,26,27)
InChIKey QPCDCPDFJACHGM-UHFFFAOYSA-N
Literature Reference DOI 10.1002/rcm.764
Molecular Weight 393.349 g/mol
SMILES OC(CN(CCN(CC(=O)O)CCN(CC(O)=O)CC(O)=O)CC(O)=O)=O
SPLASH splash10-00di-9500000000-83f3dc713b4c2f7ad575
Source of Spectrum RCM-16-1625-PA
Wiley ID 1819741