O-(2,3,4,5,6-Pentafluorobenzyl)hydroxylamine hydrochloride(57981-02-9) IR1
Molecular FormulaC7H5ClF5NO
Molecular Weight249.57
InChIInChI=1S/C7H4F5NO.ClH/c8-3-2(1-14-13)4(9)6(11)7(12)5(3)10;/h1,13H2;1H
InChIKey HVMVKNXIMUCYJA-UHFFFAOYSA-N
SmilesC1(CON)C(F)=C(C(F)=C(F)C=1F)F.Cl
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MassMS-IW-1014 O-(2,3,4,5,6-pentafluorobenzyl)hydroxylamine hydrochloride C7H4F5NO HCl (Mass of molecular ion: 213)
Source Temperature: 130 °C Sample Temperature: 120 °C Direct, 75 eV
31.0 1.4 36.0 4.6 38.0 1.6 69.0 1.0 81.0 1.0 93.0 1.6 99.0 1.8 117.0 2.5 119.0 1.1 131.0 2.1 150.0 1.1 155.0 1.7 161.0 5.5 162.0 1.2 167.0 2.6 168.0 1.0 181.0 100.0 182.0 7.9 195.0 3.7 213.0 2.6
400 MHz in D2O
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1H NMR 399.65 MHz C7 H4 F5 N O 0.033 g : 0.5 ml D2O O-(2,3,4,5,6-pentafluorobenzyl)hydroxylamine hydrochloride 
Assign. Shift(ppm)
A 5.259 THE SOLVENT SIGNAL REMOVED.
Hz ppm Int.2108.76 5.277 28 2102.05 5.260 1000 2094.60 5.242 23 2094.24 5.241 23
in DMSO-d6
KBr disc
