2,4,6-Trimethoxytoluene(14107-97-2) IR1
Product Name2,4,6-Trimethoxytoluene
CAS14107-97-2
Molecular FormulaC10H14O3
Molecular Weight182.22
InChIInChI=1S/C10H14O3/c1-7-9(12-3)5-8(11-2)6-10(7)13-4/h5-6H,1-4H3
InChIKey TZPKFPYZCMHDHL-UHFFFAOYSA-N
SmilesC1(OC)=CC(OC)=CC(OC)=C1C
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MassMS-NW-7520 2,4,6-trimethoxytoluene C10H14O3 (Mass of molecular ion: 182)
Source Temperature: 240 °C Sample Temperature: 170 °C Reservoir, 75 eV
15.0 5.9 27.0 3.3 28.0 1.8 29.0 1.0 38.0 1.4 39.0 6.8 40.0 1.3 41.0 2.3 43.0 2.1 45.0 1.2 50.0 2.6 51.0 5.7 52.0 3.2 53.0 4.4 55.0 1.9 59.0 3.0 62.0 1.0 63.0 2.5 64.0 1.6 65.0 6.0 66.0 5.3 67.0 1.9 69.0 8.1 77.0 7.5 78.0 4.2 79.0 4.2 80.0 1.8 81.0 1.9 83.0 1.1 91.0 7.6 92.0 2.1 93.0 3.8 94.0 2.2 95.0 3.1 96.0 2.0 105.0 1.8 106.0 1.2 107.0 3.7 108.0 3.8 109.0 8.0 110.0 1.1 120.0 3.7 121.0 17.1 122.0 3.9 123.0 4.4 124.0 4.9 125.0 2.4 135.0 5.6 136.0 7.7 137.0 7.2 138.0 5.5 139.0 15.4 140.0 1.4 149.0 1.4 150.0 3.8 151.0 24.1 152.0 5.8 153.0 21.3 154.0 2.3 163.0 1.0 164.0 2.7 165.0 2.3 166.0 1.0 167.0 18.0 168.0 5.2 181.0 22.5 182.0 100.0 183.0 10.9 184.0 1.3 196.0 7.4 197.0 1.0
parameter in CDCl3
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1H NMR 300 MHz C10 H14 O3 0.05 ml : 0.5 ml CDCl3 2,4,6-trimethoxytoluene 
Parameter ppm Hz
D(A) 6.115 D(B) 3.768 D(C) 3.768 D(D) 2.018
Hz ppm Int.1834.50 6.115 222 1130.41 3.768 1000 605.39 2.018 333
in CDCl3
liquid film
