N-TERT-BUTYLACRYLAMIDE(107-58-4) MS

Product NameN-TERT-BUTYLACRYLAMIDE

CAS 107-58-4

Molecular FormulaC7H13NO

Molecular Weight127.18

InChIInChI=1S/C7H13NO/c1-5-6(9)8-7(2,3)4/h5H,1H2,2-4H3,(H,8,9)

InChIKey XFHJDMUEHUHAJW-UHFFFAOYSA-N

SmilesC(NC(C)(C)C)(=O)C=C

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Mass

MS-KW-0259          
N-tert-butylacrylamide
C7H13NO             (Mass of molecular ion:    127)

   Source Temperature: 230 °C
   Sample Temperature: 150 °C
   Reservoir, 75 eV

      15.0       1.8
      26.0       1.6
      27.0      14.5
      28.0       3.5
      29.0       5.4
      30.0       1.0
      39.0       4.0
      40.0       1.0
      41.0      12.5
      42.0       5.4
      44.0       1.2
      53.0       1.5
      54.0       1.4
      55.0      47.1
      56.0       9.9
      57.0      11.8
      58.0     100.0
      59.0       3.9
      72.0      32.7
      73.0       1.2
      84.0       1.4
     112.0      19.6
     113.0       1.4
     127.0      14.2
     128.0       1.4

400 MHz in CDCl3

¹H NMR	399.65 MHz
C₇H₁₃NO	0.041 g : 0.5 ml CDCl₃
N-tert-butylacrylamide

    Assign.     Shift(ppm)

     A           6.208
     B           6.113
     C           5.9
     D           5.545
     E           1.393

     Hz     ppm     Int.

   2494.15   6.239     44
   2492.31   6.235     48
   2477.30   6.197    103
   2475.35   6.192     94
   2454.11   6.139     85
   2444.22   6.114     88
   2437.26   6.097     36
   2427.25   6.072     44
   2368.29   5.924     13
   2222.42   5.560     75
   2220.46   5.555     70
   2212.41   5.535     67
   2210.58   5.530     64
    618.90   1.549      7
    556.65   1.393   1000
    492.44   1.232      7

in CDCl3