N-(2-CARBOXYETHYL)IMINODIACETIC ACID(6245-75-6) ¹³C NMR

Product NameN-(2-CARBOXYETHYL)IMINODIACETIC ACID

CAS 6245-75-6

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             2.391

Spectral Code: 1H NMR : 400 MHz in DMSO-d6

       ppm   Int.  Assign.

      173.22   492      1
      172.06  1000      2
       54.49   749      3
       49.64   388      4
       32.50   410      5

Spectral Code: 13C NMR : in DMSO-d6

Spectral Code: IR : KBr disc

Spectral Code: Raman : 4880 A,200 M,powder

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N-(2-CARBOXYETHYL)IMINODIACETIC ACID(6245-75-6) 13C NMR

N-(2-CARBOXYETHYL)IMINODIACETIC ACID(6245-75-6) ¹³C NMR