4-Fluoro-4'-hydroxybenzophenone(25913-05-7) IR2
Product Name4-Fluoro-4'-hydroxybenzophenone
CAS25913-05-7
Molecular FormulaC13H9FO2
Molecular Weight216.21
InChIInChI=1S/C13H9FO2/c14-11-5-1-9(2-6-11)13(16)10-3-7-12(15)8-4-10/h1-8,15H
InChIKey HLRVUOFDBXRZBI-UHFFFAOYSA-N
SmilesC(C1=CC=C(F)C=C1)(C1=CC=C(O)C=C1)=O
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MassMS-IW-1351 4-fluoro-4'-hydroxybenzophenone C13H9FO2 (Mass of molecular ion: 216)
Source Temperature: 180 °C Sample Temperature: 110 °C Direct, 75 eV
39.0 3.8 63.0 1.6 65.0 7.9 75.0 4.8 93.0 12.6 94.0 6.6 95.0 18.2 96.0 1.3 121.0 100.0 122.0 7.9 123.0 30.2 124.0 2.3 133.0 2.2 157.0 1.2 159.0 3.0 187.0 1.5 199.0 3.3 215.0 7.7 216.0 63.4 217.0 9.8 218.0 1.0
400 MHz in DMSO-d6
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1H NMR 399.65 MHz C13 H9 F O2 0.042 g : 0.5 ml DMSO-d6 4-fluoro-4'-hydroxybenzophenone 
Assign. Shift(ppm)
A 10.5 B 7.771 C 7.677 D 7.368 E 6.929
Hz ppm Int.4186.70 10.476 786 3116.15 7.798 69 3113.10 7.790 435 3111.27 7.785 238 3107.60 7.776 480 3104.55 7.769 582 3101.20 7.760 222 3098.91 7.755 503 3096.16 7.748 108 3075.41 7.696 119 3072.66 7.689 880 3070.83 7.684 420 3065.95 7.672 288 3063.96 7.667 1000 3061.37 7.661 201 2956.24 7.398 73 2953.34 7.390 480 2951.51 7.386 230 2946.78 7.374 190 2944.64 7.369 885 2942.66 7.364 309 2937.93 7.352 150 2935.79 7.346 457 2933.04 7.340 89 2776.18 6.947 128 2773.44 6.940 940 2771.61 6.936 430 2766.72 6.923 274 2764.89 6.919 937 2762.15 6.912 186
KBr disc
nujol mull
4880 A,200 M,powder
