288-94-8

Tetrazole(288-94-8) IR1

Product NameTetrazole

CAS 288-94-8

Molecular FormulaCH2N4

Molecular Weight70.05

InChIInChI=1S/CH2N4/c1-2-4-5-3-1/h1H,(H,2,3,4,5)

InChIKey KJUGUADJHNHALS-UHFFFAOYSA-N

SmilesN1=CN=NN1

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Tetrazole(288-94-8) IR1
Mass

MS-NW-9513          
1H-tetrazole
CH2N4               (Mass of molecular ion:     70)

   Source Temperature: 170 °C
   Sample Temperature: 130 °C
   Direct, 75 eV

      12.0       6.5
      13.0      28.6
      14.0      20.2
      15.0       8.3
      16.0       1.5
      17.0       4.5
      18.0      23.4
      21.0       2.0
      26.0       9.7
      27.0      50.7
      28.0      86.8
      29.0      34.3
      40.0       2.2
      41.0      16.7
      42.0     100.0
      43.0      40.4
      44.0       1.6
      70.0      36.8
      71.0      16.8

400 MHz in DMSO-d6

Tetrazole(288-94-8) IR1

¹H NMR	399.65 MHz
C H₂ N₄	0.042 g : 0.5 ml DMSO-d₆
1H-tetrazole

    Assign.     Shift(ppm)

      A             9.449

     Hz     ppm     Int.

   3776.37   9.450   1000
   3770.51   9.435     25

D2O

in DMSO-d6

KBr disc

nujol mull

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