3-BROMOPHENYL ISOTHIOCYANATE(2131-59-1) 1H NMR
Molecular FormulaC7H4BrNS
Molecular Weight214.08
InChIInChI=1S/C7H4BrNS/c8-6-2-1-3-7(4-6)9-5-10/h1-4H
InChIKey ZMGMGHNOACSMQN-UHFFFAOYSA-N
SmilesC1(Br)=CC=CC(N=C=S)=C1
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![](https://www.chemicalbook.com/Spectrum/2131-59-1_MS.gif)
Mass
MS-IW-9455
m-bromophenyl isothiocyanate
C7H4BrNS (Mass of molecular ion: 213)
Source Temperature: 220 °C
Sample Temperature: 150 °C
Reservoir, 75 eV
27.0 1.0
32.0 1.2
37.0 4.5
38.0 4.8
39.0 5.2
44.0 2.3
45.0 1.5
49.0 2.2
50.0 22.4
51.0 6.5
52.0 1.2
61.0 2.2
62.0 3.2
63.0 9.4
64.0 5.4
66.5 2.6
67.0 11.6
67.5 1.1
69.0 1.6
70.0 2.2
73.0 2.1
74.0 10.1
75.0 27.0
76.0 19.8
77.0 1.4
81.0 1.0
82.0 1.3
83.0 1.8
84.0 1.2
88.0 1.3
90.0 17.6
91.0 1.3
102.0 5.3
106.5 5.9
107.0 6.5
107.5 6.0
108.0 2.2
133.0 3.2
134.0 67.2
135.0 6.2
136.0 3.3
155.0 22.0
156.0 1.6
157.0 21.5
158.0 1.5
183.0 1.0
213.0 98.2
214.0 9.1
215.0 100.0
216.0 9.1
217.0 4.7