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Back ChemicalBook Home>CAS DataBase List>3913-23-3More Spectrum> 2-METHOXY-5-NITROBENZYL BROMIDE(3913-23-3) IR1

3913-23-3

2-METHOXY-5-NITROBENZYL BROMIDE(3913-23-3) IR1

Molecular FormulaC8H8BrNO3

Molecular Weight246.06

InChIInChI=1S/C8H8BrNO3/c1-13-8-3-2-7(10(11)12)4-6(8)5-9/h2-4H,5H2,1H3

InChIKey JRHMPHMGOGMNDU-UHFFFAOYSA-N

SmilesC1(OC)=CC=C([N+]([O-])=O)C=C1CBr

  • 2-METHOXY-5-NITROBENZYL BROMIDE(3913-23-3) IR1
    Mass

    MS-NW-6847          
    2-bromomethyl-4-nitroanisole
    C8H8BrNO3           (Mass of molecular ion:    245)
    

       Source Temperature: 270 °C
       Sample Temperature: 190 °C
       Reservoir, 75 eV
    

          18.0       1.0
          27.0       1.0
          30.0       5.4
          38.0       1.5
          39.0       3.4
          50.0       4.4
          51.0      11.4
          52.0       1.3
          53.0       1.0
          62.0       1.7
          63.0       4.2
          64.0       1.3
          65.0       3.1
          74.0       1.3
          75.0       1.3
          76.0       1.8
          77.0       8.5
          78.0       8.0
          79.0       1.6
          89.0       9.4
          90.0      18.7
          91.0       6.0
          92.0       1.8
          93.0       1.1
         105.0       4.5
         106.0       2.0
         108.0       1.6
         120.0       8.4
         121.0       1.0
         136.0      12.3
         137.0       1.4
         150.0       2.0
         166.0     100.0
         167.0       9.7
         168.0       1.1
         245.0       2.9
         247.0       2.7
    

400 MHz in CDCl3

  • 2-METHOXY-5-NITROBENZYL BROMIDE(3913-23-3) IR1

    1H NMR 399.65 MHz
    C8 H8 Br N O3 0.041 g : 0.5 ml CDCl3
    2-bromomethyl-4-nitroanisole
    ChemicalStructure
        Assign.     Shift(ppm)
    A 8.258 B 8.219 C 6.971 D 4.539 E 4.022

         Hz     ppm     Int.
    

       3302.25   8.263    134
       3299.44   8.256    186
       3290.41   8.234    124
       3287.60   8.227     80
       3281.37   8.211    117
       3278.56   8.204     91
       2790.65   6.983    144
       2781.62   6.961    140
       1814.09   4.540    584
       1607.67   4.023   1000
    

in CDCl3

  • 2-METHOXY-5-NITROBENZYL BROMIDE(3913-23-3) IR1

KBr disc

  • 2-METHOXY-5-NITROBENZYL BROMIDE(3913-23-3) IR1

nujol mull

  • 2-METHOXY-5-NITROBENZYL BROMIDE(3913-23-3) IR1

4880 A,200 M,powder

  • 2-METHOXY-5-NITROBENZYL BROMIDE(3913-23-3) IR1

2-METHOXY-5-NITROBENZYL BROMIDE(3913-23-3) IR1 Atlas of Related Products

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