3-BROMOFORMANILIDE(37831-25-7) ¹³C NMR

Product Name3-BROMOFORMANILIDE

CAS 37831-25-7

Molecular FormulaC7H6BrNO

Molecular Weight200.03

InChIInChI=1S/C7H6BrNO/c8-6-2-1-3-7(4-6)9-5-10/h1-5H,(H,9,10)

InChIKey QYYDYYDGGZJJCS-UHFFFAOYSA-N

SmilesC(NC1=CC=CC(Br)=C1)=O

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¹³CNMR

IR1

IR2

Mass

MS2003-01540WA      
3'-bromoformanilide
C7H6BrNO            (Mass of molecular ion:    199)

   Source Temperature: 250 °C
   Sample Temperature: 270 °C
   Reservoir, 70 eV

      18.0       1.0
      28.0       1.0
      29.0       6.0
      37.0       4.4
      38.0      10.3
      39.0      17.3
      40.0       2.0
      41.0       3.7
      42.0       1.4
      44.0       1.8
      45.5       2.7
      49.0       1.3
      50.0       7.9
      51.0       4.2
      52.0       7.6
      61.0       4.5
      62.0       9.2
      63.0      27.3
      64.0      18.6
      65.0      76.9
      66.0       8.3
      73.0       1.4
      74.0       5.2
      75.0       6.2
      76.0       4.3
      77.0       1.6
      88.0       1.1
      90.0       7.7
      91.0      20.9
      92.0     100.0
      93.0       8.5
     117.0       2.6
     119.0       4.5
     120.0       1.1
     127.0       2.6
     143.0       5.3
     144.0       1.5
     145.0       5.2
     146.0       1.4
     155.0       2.5
     157.0       1.8
     170.0       2.0
     171.0      77.2
     172.0      10.0
     173.0      75.1
     174.0       7.9
     197.0       1.1
     199.0      93.0
     200.0       7.7
     201.0      89.6
     202.0       7.1

in CDCl3

KBr disc

nujol mull

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