4-HYDROXYPHENYLDIMETHYLSULFONIUM METHYL SULFATE(32279-04-2) IR1
Molecular FormulaC9H14O5S2
Molecular Weight266.33
InChIInChI=1S/C8H10OS.CH4O4S/c1-10(2)8-5-3-7(9)4-6-8;1-5-6(2,3)4/h3-6H,1-2H3;1H3,(H,2,3,4)
InChIKey PKQZVASULXKBJV-UHFFFAOYSA-N
SmilesS([O-])(OC)(=O)=O.[S+](C)(C)C1=CC=C(O)C=C1
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Mass
MS2001-00898WA
4-hydroxyphenyldimethyl sulfonium methyl sulfate
C9H14O5S2 (Mass of molecular ion: 266)
Source Temperature: 225 °C
Sample Temperature: 80 °C
Direct, 70 eV
comment: water solution, remove water peaks
14.0 1.5
15.0 12.4
18.0 1.3
27.0 1.6
28.0 3.6
29.0 29.7
30.0 4.2
31.0 44.7
32.0 32.2
33.0 1.1
38.0 2.2
39.0 7.9
45.0 9.9
46.0 1.1
47.0 1.0
48.0 2.3
50.0 2.1
51.0 2.5
53.0 5.4
55.0 1.5
61.0 1.5
62.0 3.4
63.0 6.7
64.0 2.0
65.0 4.9
66.0 5.2
67.0 1.1
69.0 6.9
70.0 4.6
71.0 2.3
74.0 1.1
77.0 2.6
78.0 1.1
79.0 3.1
81.0 9.6
82.0 1.2
85.0 1.2
94.0 3.2
95.0 21.7
96.0 14.2
97.0 16.1
98.0 1.9
107.0 1.9
111.0 1.7
124.0 1.2
125.0 77.9
126.0 6.8
127.0 3.8
139.0 3.7
140.0 100.0
141.0 8.4
142.0 4.8
154.0 1.0