3-Nitrophenacylbromide(2227-64-7) 13C NMR
Molecular FormulaC8H6BrNO3
Molecular Weight244.04
InChIInChI=1S/C8H6BrNO3/c9-5-8(11)6-2-1-3-7(4-6)10(12)13/h1-4H,5H2
InChIKey GZHPNIQBPGUSSX-UHFFFAOYSA-N
SmilesC(=O)(C1=CC=CC([N+]([O-])=O)=C1)CBr
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Mass
MS-IW-6915
2-bromo-3'-nitroacetophenone
C8H6BrNO3 (Mass of molecular ion: 243)
Source Temperature: 140 °C
Sample Temperature: 110 °C
Direct, 75 eV
42.0 1.3
50.0 4.8
51.0 1.0
63.0 1.7
64.0 1.3
74.0 1.7
75.0 3.2
76.0 10.0
77.0 1.0
89.0 3.3
90.0 5.4
92.0 2.4
104.0 18.1
105.0 1.4
118.0 1.3
122.0 1.3
150.0 100.0
151.0 8.3
243.0 3.1
245.0 3.0