2-(2-Aminoethyl)isothiourea dihydrobromide(56-10-0) IR1

Product Name2-(2-Aminoethyl)isothiourea dihydrobromide

CAS 56-10-0

Molecular FormulaC3H11Br2N3S

Molecular Weight281.01

InChIInChI=1S/C3H9N3S.2BrH/c4-1-2-7-3(5)6;;/h1-2,4H2,(H3,5,6);2*1H

InChIKey XDVMCVGTDUKDHL-UHFFFAOYSA-N

SmilesS(CCN)C(=N)N.Br.Br

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Mass

MS-NW-9268          
2-(2-aminoethyl)isothiouronium bromide hydrobromide
C3H10BrN3S HBr      (Mass of molecular ion:    119)

   Source Temperature: 210 °C
   Sample Temperature: 250 °C
   Direct, 75 eV

      15.0       2.3
      16.0       5.1
      17.0      10.2
      18.0      28.7
      27.0       4.4
      28.0      12.6
      29.0       1.3
      30.0     100.0
      31.0       2.2
      32.0       2.0
      36.0       2.6
      38.0       1.3
      39.5       2.1
      40.0       2.7
      40.5       2.1
      41.0       3.2
      42.0       8.6
      43.0      16.9
      44.0       2.7
      45.0       6.8
      46.0       1.7
      47.0       3.3
      48.0       1.2
      55.0       2.8
      56.0       9.0
      57.0       1.3
      58.0       2.1
      59.0      14.1
      60.0      17.6
      61.0       1.6
      74.0       1.1
      76.0      19.8
      77.0       4.9
      78.0       1.3
      79.0      30.8
      80.0      96.0
      81.0      30.4
      82.0      92.6
     101.0      14.6
     102.0      20.7
     103.0       2.0
     104.0       1.0
     123.0       1.1
     125.0       1.0

in DMSO-d6