535-87-5

3,5-Diaminobenzoic acid(535-87-5) IR1

Product Name3,5-Diaminobenzoic acid

CAS 535-87-5

Molecular FormulaC7H8N2O2

Molecular Weight152.15

InChIInChI=1S/C7H8N2O2/c8-5-1-4(7(10)11)2-6(9)3-5/h1-3H,8-9H2,(H,10,11)

InChIKey UENRXLSRMCSUSN-UHFFFAOYSA-N

SmilesC(O)(=O)C1=CC(N)=CC(N)=C1

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¹HNMR

IR1

IR2

3,5-Diaminobenzoic acid(535-87-5) IR1
Mass

MS-NW-4757          
3,5-diaminobenzoic acid
C7H8N2O2            (Mass of molecular ion:    152)

   Source Temperature: 200 °C
   Sample Temperature: 130 °C
   Direct, 75 eV

      17.0       1.3
      18.0       6.8
      28.0       4.1
      38.0       2.0
      39.0       3.1
      40.0       1.6
      41.0       2.8
      42.0       3.3
      50.0       1.1
      51.0       2.6
      52.0       4.5
      53.0       7.1
      53.5       1.5
      54.0       1.9
      62.0       1.4
      63.0       2.9
      64.0       1.0
      65.0       2.1
      66.0       2.8
      67.0       2.6
      67.5       1.0
      68.0       1.1
      76.0       1.0
      78.0       2.6
      79.0       6.2
      80.0      14.0
      81.0       2.9
      90.0       1.1
      95.0       3.9
      96.0       2.4
     105.0       2.4
     106.0       6.8
     107.0      23.9
     108.0       4.5
     123.0       2.3
     124.0       7.7
     125.0       1.3
     135.0       9.1
     151.0       1.2
     152.0     100.0
     153.0       8.5