4-TRIFLUOROMETHYL-2,3,5,6-TETRAFLUOROTHIOPHENOL(651-84-3) 13C NMR
Product Name4-TRIFLUOROMETHYL-2,3,5,6-TETRAFLUOROTHIOPHENOL
CAS651-84-3
Molecular FormulaC7HF7S
Molecular Weight250.14
InChIInChI=1S/C7HF7S/c8-2-1(7(12,13)14)3(9)5(11)6(15)4(2)10/h15H
InChIKey BXMOMKVOHOSVJH-UHFFFAOYSA-N
SmilesC1(S)=C(F)C(F)=C(C(F)(F)F)C(F)=C1F
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MassMS-IW-7201 2,3,5,6-tetrafluoro-4-(trifluoromethyl)benzenethiol C7HF7S (Mass of molecular ion: 250)
Source Temperature: 210 °C Sample Temperature: 150 °C Reservoir, 75 eV
28.0 2.3 31.0 2.3 45.0 1.0 63.0 17.9 69.0 10.3 79.0 1.8 87.0 4.8 93.0 4.1 98.0 2.0 99.0 1.9 106.0 1.0 111.0 4.3 113.0 1.9 115.5 1.5 117.0 7.9 118.0 1.2 125.0 3.2 130.0 1.2 131.0 2.2 137.0 7.4 148.0 1.7 149.0 1.3 150.0 1.4 155.0 8.7 156.0 1.3 161.0 2.4 162.0 1.2 167.0 2.2 168.0 4.3 179.0 1.0 180.0 7.2 181.0 18.2 182.0 1.8 186.0 8.5 187.0 3.2 199.0 8.7 200.0 7.7 205.0 15.8 206.0 4.5 211.0 7.8 217.0 4.9 218.0 13.1 219.0 1.0 230.0 7.9 231.0 19.4 232.0 2.0 249.0 13.8 250.0 100.0 251.0 9.0 252.0 4.7
in CDCl3
liquid film
