Product Name4-CHLORO-4'-HYDROXYBIPHENYL
CAS28034-99-3
Molecular FormulaC12H9ClO
Molecular Weight204.65
InChIInChI=1S/C12H9ClO/c13-11-5-1-9(2-6-11)10-3-7-12(14)8-4-10/h1-8,14H
InChIKey ICVFJPSNAUMFCW-UHFFFAOYSA-N
SmilesC1(C2=CC=C(Cl)C=C2)=CC=C(O)C=C1
Mass
MS-IW-2677 4'-chloro-4-biphenylol C12H9ClO (Mass of molecular ion: 204)
Source Temperature: 110 °C Sample Temperature: 100 °C Direct, 75 eV
18.0 1.1 28.0 1.3 39.0 1.8 50.0 1.1 51.0 1.5 55.0 2.3 62.0 1.3 63.0 3.0 69.0 1.8 69.5 2.5 70.0 3.1 74.0 1.4 75.0 2.4 84.0 4.9 84.5 1.1 86.0 1.0 87.0 1.2 89.0 1.8 102.0 6.2 103.0 2.0 113.0 1.7 114.0 1.7 115.0 6.3 139.0 9.0 140.0 3.3 141.0 13.2 142.0 1.8 149.0 3.3 151.0 2.2 152.0 1.4 168.0 5.3 169.0 2.9 175.0 3.1 203.0 2.1 204.0 100.0 205.0 14.0 206.0 33.0 207.0 4.2
400 MHz in CDCl3
1H NMR | 399.65 MHz |
C12 H9 Cl O | saturated in CDCl3 |
4'-chloro-4-biphenylol |
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Assign. Shift(ppm) |
Hz ppm Int.
2982.18 7.462 67 2979.74 7.456 485 2977.66 7.451 200 2974.98 7.444 103 2973.14 7.440 296 2972.05 7.437 752 2970.95 7.434 1000 2969.97 7.432 355 2968.63 7.429 174 2965.45 7.421 232 2963.26 7.415 744 2960.33 7.408 85 2949.46 7.381 139 2947.14 7.375 819 2944.95 7.369 247 2940.43 7.358 191 2938.35 7.353 531 2935.91 7.347 61 2764.28 6.917 86 2761.35 6.910 721 2759.16 6.904 230 2754.76 6.893 215 2752.56 6.888 701 2749.63 6.881 72 2057.98 5.150 132
in CDCl3
KBr disc
nujol mull
4-CHLORO-4'-HYDROXYBIPHENYL(28034-99-3) IR2 Atlas of Related Products
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