Product Name1,2,3-Trimethoxybenzene
CAS634-36-6
Molecular FormulaC9H12O3
Molecular Weight168.19
InChIInChI=1S/C9H12O3/c1-10-7-5-4-6-8(11-2)9(7)12-3/h4-6H,1-3H3
InChIKey CRUILBNAQILVHZ-UHFFFAOYSA-N
SmilesC1(OC)=CC=CC(OC)=C1OC
Mass
MS-NW-8746 1,2,3-trimethoxybenzene C9H12O3 (Mass of molecular ion: 168)
Source Temperature: 260 °C Sample Temperature: 140 °C Reservoir, 75 eV
15.0 2.1 28.0 1.9 38.0 1.9 39.0 12.9 41.0 1.7 50.0 2.8 51.0 7.1 52.0 2.0 53.0 3.5 55.0 2.2 63.0 1.7 64.0 1.6 65.0 9.8 66.0 1.7 67.0 2.6 76.0 1.3 77.0 7.8 78.0 1.3 79.0 3.0 80.0 1.0 82.0 3.1 92.0 2.3 93.0 25.1 94.0 2.4 95.0 18.7 96.0 1.2 107.0 6.0 108.0 5.9 109.0 1.3 110.0 30.4 111.0 2.1 122.0 1.6 123.0 1.1 125.0 27.3 126.0 2.0 137.0 1.6 138.0 3.6 152.0 2.3 153.0 69.1 154.0 6.1 168.0 100.0 169.0 9.9 170.0 1.1
400 MHz in CDCl3
1H NMR | 399.65 MHz |
C9 H12 O3 | 0.039 g : 0.5 ml CDCl3 |
1,2,3-trimethoxybenzene |
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Assign. Shift(ppm) |
Hz ppm Int.
2802.25 7.012 66 2793.95 6.991 106 2785.52 6.970 79 2634.40 6.592 237 2625.98 6.571 218 1541.99 3.859 1000 1540.28 3.855 747
in CDCl3
KBr disc
nujol mull
4880 A,200 M,powder
1,2,3-Trimethoxybenzene(634-36-6) 13C NMR Atlas of Related Products
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