Product Name2-CHLORO-5-METHYLPHENOL
CAS615-74-7
Molecular FormulaC7H7ClO
Molecular Weight142.58
InChIInChI=1S/C7H7ClO/c1-5-2-3-6(8)7(9)4-5/h2-4,9H,1H3
InChIKey SMFHPCZZAAMJJO-UHFFFAOYSA-N
SmilesC1(O)=CC(C)=CC=C1Cl
Mass
MS-KW-0492 6-chloro-m-cresol C7H7ClO (Mass of molecular ion: 142)
Source Temperature: 240 °C Sample Temperature: 150 °C Reservoir, 75 eV
27.0 2.1 37.0 1.3 38.0 3.6 39.0 7.2 50.0 3.5 51.0 10.6 52.0 4.1 53.0 6.5 61.0 1.0 62.0 1.7 63.0 3.2 71.0 2.8 72.0 1.2 73.0 1.9 74.0 1.4 75.0 1.9 77.0 24.5 78.0 5.7 79.0 7.7 89.0 1.3 105.0 2.5 107.0 100.0 108.0 7.8 113.0 1.1 141.0 15.3 142.0 64.9 143.0 9.9 144.0 21.0 145.0 1.6
90 MHz in CDCl3
1H NMR | 89.56 MHz |
C7 H7 Cl O | 0.051 g : 0.5 ml CDCl3 |
6-chloro-m-cresol |
Assign. Shift(ppm) |
Hz ppm Int.
645.56 7.209 181 637.50 7.119 256 612.81 6.843 113 612.50 6.839 117 612.13 6.835 124 610.81 6.821 153 610.44 6.816 157 601.81 6.720 106 601.13 6.713 113 600.50 6.706 74 599.75 6.697 88 599.13 6.690 88 593.69 6.629 74 593.06 6.622 78 592.38 6.615 51 591.69 6.607 65 591.00 6.599 66 488.38 5.454 1000 486.50 5.433 33 203.94 2.278 985
in CDCl3
CCl4 solution
KBr disc
Nujol
4880 A,200 M,powder
2-CHLORO-5-METHYLPHENOL(615-74-7) IR2 Atlas of Related Products
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