2,6-Dichloro-4-methylphenol(2432-12-4) MS
Product Name2,6-Dichloro-4-methylphenol
CAS2432-12-4
Molecular FormulaC7H6Cl2O
Molecular Weight177.03
InChIInChI=1S/C7H6Cl2O/c1-4-2-5(8)7(10)6(9)3-4/h2-3,10H,1H3
InChIKey YXEOEPYIBGTLML-UHFFFAOYSA-N
SmilesC1(O)=C(Cl)C=C(C)C=C1Cl
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MassMS-IW-4099 2,6-dichloro-p-cresol C7H6Cl2O (Mass of molecular ion: 176)
Source Temperature: 220 °C Sample Temperature: 150 °C Reservoir, 75 eV
27.0 1.2 38.0 5.0 39.0 1.4 50.0 4.8 51.0 13.0 52.0 4.5 53.0 4.3 55.0 1.0 55.5 1.0 56.0 4.9 57.0 1.6 61.0 1.9 62.0 1.9 63.0 1.8 70.0 2.4 73.0 1.8 74.0 2.3 75.0 10.7 76.0 2.1 77.0 30.6 78.0 2.8 85.0 2.0 87.0 1.6 88.0 2.2 89.0 1.9 97.0 1.0 105.0 5.8 111.0 8.0 112.0 3.8 113.0 4.2 114.0 1.3 139.0 4.5 140.0 2.5 141.0 100.0 142.0 8.6 143.0 31.8 144.0 2.5 175.0 16.4 176.0 56.6 177.0 14.6 178.0 36.3 179.0 4.5 180.0 5.9
400 MHz in CDCl3
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1H NMR 399.65 MHz C7 H6 Cl2 O 0.05 ml : 0.5 ml CDCl3 2,6-dichloro-p-cresol 
Assign. Shift(ppm)
A 7.025 B 5.43 C 2.218
Hz ppm Int.2807.74 7.026 688 2807.01 7.024 658 2169.80 5.430 51 887.33 2.221 835 886.60 2.219 1000
in CDCl3
liquid film
