3,4,5,6-TETRAFLUORO-2-HYDROXYBENZOIC ACID(14742-36-0) MS
Product Name3,4,5,6-TETRAFLUORO-2-HYDROXYBENZOIC ACID
CAS14742-36-0
Molecular FormulaC7H2F4O3
Molecular Weight210.08
InChIInChI=1S/C7H2F4O3/c8-2-1(7(13)14)6(12)5(11)4(10)3(2)9/h12H,(H,13,14)
InChIKey WKYGDMSOKGXAAY-UHFFFAOYSA-N
SmilesC(O)(=O)C1=C(O)C(F)=C(F)C(F)=C1F
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MassMS-KW-0031 tetrafluorosalicylic acid C7H2F4O3 (Mass of molecular ion: 210)
Source Temperature: 160 °C Sample Temperature: 130 °C Direct, 75 eV
18.0 1.4 28.0 1.4 31.0 6.2 44.0 1.0 45.0 2.5 51.0 1.2 55.0 1.1 68.0 2.0 69.0 4.6 71.0 2.4 72.5 1.4 74.0 1.6 75.0 2.1 79.0 2.3 82.0 4.3 86.0 3.2 87.0 2.5 91.0 1.0 93.0 4.0 95.0 1.9 96.0 3.4 96.5 1.8 98.0 2.9 99.0 3.5 105.0 1.8 117.0 13.2 118.0 2.0 136.0 36.0 137.0 12.5 145.0 1.5 148.0 1.3 164.0 35.9 165.0 4.9 166.0 1.4 173.0 1.2 192.0 100.0 193.0 17.6 194.0 1.4 208.0 1.2 210.0 39.9 211.0 3.2
in DMSO-d6
in DMSO-d6
KBr disc
nujol mull
