5-BROMO-2,4-DIHYDROXYBENZOIC ACID(7355-22-8) MS
Product Name5-BROMO-2,4-DIHYDROXYBENZOIC ACID
CAS7355-22-8
Molecular FormulaC7H5BrO4
Molecular Weight233.02
InChIInChI=1S/C7H5BrO4/c8-4-1-3(7(11)12)5(9)2-6(4)10/h1-2,9-10H,(H,11,12)
InChIKey ZRBCISXJLHZOMS-UHFFFAOYSA-N
SmilesC(O)(=O)C1=CC(Br)=C(O)C=C1O
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MassMS-NW-9505 5-bromo-2,4-dihydroxybenzoic acid C7H5BrO4 (Mass of molecular ion: 232)
Source Temperature: 180 °C Sample Temperature: 120 °C Direct, 75 eV
17.0 2.5 18.0 13.8 27.0 1.0 28.0 3.9 29.0 1.4 37.0 1.9 38.0 2.2 39.0 3.8 41.0 1.0 44.0 5.7 45.0 1.6 49.0 1.3 50.0 6.1 51.0 11.6 52.0 2.5 53.0 8.4 54.0 2.6 55.0 1.4 61.0 1.6 62.0 2.9 63.0 1.7 65.0 1.3 66.0 1.9 69.0 12.7 77.0 1.7 78.0 1.7 79.0 15.6 80.0 2.9 81.0 3.5 82.0 1.0 93.0 2.7 94.0 2.6 95.0 1.0 106.0 1.8 107.0 3.7 108.0 1.7 117.0 1.7 119.0 1.2 130.0 1.3 131.0 1.6 132.0 1.3 133.0 1.0 135.0 5.1 145.0 1.1 147.0 1.2 157.0 1.3 158.0 11.6 159.0 2.7 160.0 11.5 161.0 1.5 173.0 1.6 175.0 1.9 185.0 2.1 186.0 25.3 187.0 4.4 188.0 34.6 189.0 2.8 190.0 9.6 214.0 100.0 215.0 10.5 216.0 97.6 217.0 10.0 218.0 1.0 232.0 49.2 233.0 4.1 234.0 48.4 235.0 3.9 268.0 1.1 292.0 1.0 294.0 1.9
in DMSO-d6
KBr disc
nujol mull
