2,5-Dimethylbenzenesulfonic acid dihydrate(609-54-1) MS
Product Name2,5-Dimethylbenzenesulfonic acid dihydrate
CAS609-54-1
Molecular FormulaC8H10O3S
Molecular Weight186.23
InChIInChI=1S/C8H10O3S/c1-6-3-4-7(2)8(5-6)12(9,10)11/h3-5H,1-2H3,(H,9,10,11)
InChIKey IRLYGRLEBKCYPY-UHFFFAOYSA-N
SmilesC1(S(O)(=O)=O)=CC(C)=CC=C1C
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MassMS-NW-4615 p-xylene-2-sulfonic acid C8H10O3S 2H2O (Mass of molecular ion: 186)
Source Temperature: 180 °C Sample Temperature: 140 °C Direct, 75 eV
17.0 1.0 18.0 5.1 27.0 4.2 28.0 1.2 39.0 6.1 41.0 1.1 50.0 2.6 51.0 7.6 52.0 2.3 53.0 3.2 62.0 1.2 63.0 3.8 65.0 3.3 77.0 17.4 78.0 18.8 79.0 9.0 89.0 1.6 91.0 3.3 102.0 1.8 103.0 21.4 104.0 100.0 105.0 26.9 106.0 2.4 107.0 1.2 120.0 1.2 121.0 1.6 186.0 34.0 187.0 3.4 188.0 1.8
KBr disc
liquid film
