2,5-DIMETHYLANISOLE(1706-11-2) IR1
Product Name2,5-DIMETHYLANISOLE
CAS1706-11-2
Molecular FormulaC9H12O
Molecular Weight136.19
InChIInChI=1S/C9H12O/c1-7-4-5-8(2)9(6-7)10-3/h4-6H,1-3H3
InChIKey SJZAUIVYZWPNAS-UHFFFAOYSA-N
SmilesC1(C)=CC=C(C)C=C1OC
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MassMS-NW-5882 2,5-dimethylanisole C9H12O (Mass of molecular ion: 136)
Source Temperature: 270 °C Sample Temperature: 190 °C Reservoir, 75 eV
15.0 1.6 27.0 4.2 38.0 1.3 39.0 7.6 40.0 1.0 41.0 3.2 50.0 2.8 51.0 6.2 52.0 2.9 53.0 4.6 62.0 1.2 63.0 3.0 64.0 1.0 65.0 6.0 68.0 1.0 77.0 22.3 78.0 6.9 79.0 4.5 89.0 1.1 91.0 29.4 92.0 3.6 93.0 7.4 103.0 5.4 104.0 5.9 105.0 17.8 106.0 4.3 107.0 1.2 121.0 58.3 122.0 5.9 135.0 12.0 136.0 100.0 137.0 9.9
90 MHz in CDCl3
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1H NMR 89.56 MHz C9 H12 O 0.04 ml : 0.5 ml CDCl3 2,5-dimethylanisole 
Assign. Shift(ppm)
A 6.98 B 6.64 C 6.62 D 3.778 E 2.309 F 2.168
Hz ppm Int.630.13 7.036 37 629.69 7.031 40 629.56 7.030 40 622.19 6.948 66 621.75 6.943 69 598.63 6.685 58 592.31 6.614 129 338.31 3.778 1000 206.94 2.311 358 206.56 2.307 378 194.19 2.169 383
in CDCl3
liquid film
4880 A,200 M,liquid
