5111-65-9

2-Bromo-6-methoxynaphthalene(5111-65-9) IR1

Product Name2-Bromo-6-methoxynaphthalene

CAS 5111-65-9

Molecular FormulaC11H9BrO

Molecular Weight237.09

InChIInChI=1S/C11H9BrO/c1-13-11-5-3-8-6-10(12)4-2-9(8)7-11/h2-7H,1H3

InChIKey AYFJBMBVXWNYLT-UHFFFAOYSA-N

SmilesC1=C2C(C=C(OC)C=C2)=CC=C1Br

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2-Bromo-6-methoxynaphthalene(5111-65-9) IR1
Mass

MS-IW-4873          
2-bromo-6-methoxynaphthalene
C11H9BrO            (Mass of molecular ion:    236)

   Source Temperature: 130 °C
   Sample Temperature:  90 °C
   Direct, 75 eV

      39.0       1.0
      50.0       2.3
      51.0       1.6
      61.0       1.1
      62.0       4.0
      63.0       7.9
      64.0       1.6
      74.0       3.8
      75.0       3.1
      76.0       1.7
      86.0       2.6
      87.0       3.6
      88.0       5.0
      98.0       1.3
      99.0       1.4
     113.0       9.4
     114.0      26.2
     115.0       2.7
     118.0       3.3
     119.0       3.3
     126.0       9.1
     127.0       4.6
     128.0       2.9
     142.0       2.5
     156.0       1.1
     157.0       1.9
     193.0      41.1
     194.0       4.6
     195.0      40.1
     196.0       3.9
     206.0       2.0
     207.0       1.2
     208.0       1.9
     221.0      15.3
     222.0       2.0
     223.0      15.1
     224.0       1.7
     236.0     100.0
     237.0      12.4
     238.0      98.3
     239.0      11.9

400 MHz in CDCl3

2-Bromo-6-methoxynaphthalene(5111-65-9) IR1

¹H NMR	399.65 MHz
C₁₁ H₉ Br O	0.039 g : 0.5 ml CDCl₃
2-bromo-6-methoxynaphthalene

    Assign.     Shift(ppm)

      A             7.891
      B             7.612
      C             7.571
      D             7.482
      E             7.144
      F             7.066
      G             3.886

     Hz     ppm     Int.

   3154.79   7.894    126
   3153.08   7.890    125
   3047.00   7.625    111
   3037.84   7.602    123
   3031.25   7.585     93
   3022.46   7.563    143
   2994.51   7.493    126
   2992.55   7.488    119
   2985.84   7.472     80
   2983.76   7.466     78
   2860.84   7.159     95
   2858.28   7.152    107
   2851.81   7.136     86
   2849.24   7.130     99
   2825.07   7.069    126
   2822.63   7.063    108
   1553.34   3.887   1000

in CDCl3