N-(2-Carboxyethyl)iminodiacetic acid(6245-75-6) IR1
Product NameN-(2-Carboxyethyl)iminodiacetic acid
CAS6245-75-6
Molecular FormulaC7H11NO6
Molecular Weight205.17
InChIInChI=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
SmilesN(CC(=O)O)(CC(=O)O)CCC(=O)O
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Assign. Shift(ppm)
A 12. B 3.445 C 2.899 D 2.391Spectral Code: 1H NMR : 400 MHz in DMSO-d6
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ppm Int. Assign.
173.22 492 1 172.06 1000 2 54.49 749 3 49.64 388 4 32.50 410 5Spectral Code: 13C NMR : in DMSO-d6
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Spectral Code: IR : KBr disc
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Spectral Code: Raman : 4880 A,200 M,powder