4-Hexyloxybenzoic acid(1142-39-8) MS
Molecular FormulaC13H18O3
Molecular Weight222.28
InChIInChI=1S/C13H18O3/c1-2-3-4-5-10-16-12-8-6-11(7-9-12)13(14)15/h6-9H,2-5,10H2,1H3,(H,14,15)
InChIKey HBQUXMZZODHFMJ-UHFFFAOYSA-N
SmilesC(O)(=O)C1=CC=C(OCCCCCC)C=C1
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Mass
MS2003-01615WA
p-hexyloxybenzoic acid
C13H18O3 (Mass of molecular ion: 222)
Source Temperature: 250 °C
Sample Temperature: 270 °C
Reservoir, 70 eV
27.0 3.0
29.0 4.1
39.0 3.9
41.0 9.1
42.0 2.8
43.0 23.5
44.0 1.1
51.0 1.1
53.0 1.4
55.0 7.3
56.0 4.1
57.0 3.1
63.0 1.4
64.0 1.0
65.0 7.1
69.0 3.5
76.0 1.3
77.0 1.3
81.0 2.1
84.0 4.5
85.0 2.6
92.0 1.0
93.0 2.8
95.0 1.7
121.0 28.1
122.0 2.3
138.0 100.0
139.0 22.9
140.0 2.1
151.0 2.4
222.0 25.3
223.0 3.7