2-N-BUTYLAMINO-4,6-DIAMINO-1,3,5-TRIAZINE(5606-24-6) IR1

Product Name2-N-BUTYLAMINO-4,6-DIAMINO-1,3,5-TRIAZINE

CAS 5606-24-6

Molecular FormulaC7H14N6

Molecular Weight182.23

InChIInChI=1S/C7H14N6/c1-2-3-4-10-7-12-5(8)11-6(9)13-7/h2-4H2,1H3,(H5,8,9,10,11,12,13)

InChIKey CVKGSDYWCFQOKU-UHFFFAOYSA-N

SmilesN1=C(N)N=C(N)N=C1NCCCC

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    Assign.     Shift(ppm)

      A             6.463
      B     *1      6.19
      C     *1      6.04
      D             3.172
      E             1.429
      F             1.276
      G             0.871

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

       ppm   Int.  Assign.

      167.02  1000      1
      166.33   689      2
       39.48   588      3
       31.51   664      4
       19.57   714      5
       13.72   605      6

Spectral Code: 13C NMR : in DMSO-d6

Spectral Code: IR : KBr disc

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

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