Product NameDimethyl aminoterephthalate
CAS5372-81-6
Molecular FormulaC10H11NO4
Molecular Weight209.2
InChIInChI=1S/C10H11NO4/c1-14-9(12)6-3-4-7(8(11)5-6)10(13)15-2/h3-5H,11H2,1-2H3
InChIKey DSSKDXUDARIMTR-UHFFFAOYSA-N
SmilesC1(C(OC)=O)=CC=C(C(OC)=O)C=C1N
Mass
MS-IW-0841 dimethyl aminoterephthalate C10H11NO4 (Mass of molecular ion: 209)
Source Temperature: 130 °C Sample Temperature: 120 °C Direct, 75 eV
18.0 1.1 28.0 1.1 45.5 1.5 52.0 1.8 59.5 2.1 63.0 2.9 64.0 1.3 65.0 1.3 73.5 1.9 88.5 2.0 89.0 1.0 90.0 3.0 91.0 1.7 92.0 1.3 107.0 2.4 118.0 6.1 119.0 16.1 120.0 2.2 122.0 1.1 135.0 8.7 146.0 2.7 150.0 19.7 151.0 2.8 177.0 100.0 178.0 35.8 179.0 3.9 209.0 90.4 210.0 10.6 211.0 1.3
400 MHz in CDCl3
1H NMR | 399.65 MHz |
C10 H11 N O4 | 0.038 g : 0.5 ml CDCl3 |
dimethyl aminoterephthalate |
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Assign. Shift(ppm) |
Hz ppm Int.
3160.89 7.910 124 3160.40 7.908 117 3152.47 7.889 137 3152.10 7.888 125 2941.89 7.362 127 2941.41 7.360 125 2940.19 7.357 143 2939.82 7.356 126 2897.95 7.252 106 2896.24 7.247 102 2889.53 7.231 104 2887.94 7.227 96 1558.35 3.900 985 1553.10 3.887 1000
in CDCl3
KBr disc
nujol mull
Dimethyl aminoterephthalate(5372-81-6) 13C NMR Atlas of Related Products
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