1-METHYL-1,2,3,6-TETRAHYDROPYRIDINE(694-55-3) IR1
Product Name1-METHYL-1,2,3,6-TETRAHYDROPYRIDINE
CAS694-55-3
Molecular FormulaC6H11N
Molecular Weight97.16
InChIInChI=1S/C6H11N/c1-7-5-3-2-4-6-7/h2-3H,4-6H2,1H3
InChIKey AUFIRGPROMANKW-UHFFFAOYSA-N
SmilesC1N(C)CC=CC1
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MassMS-NW-6409 1-methyl-1,2,3,6-tetrahydropyridine C6H11N (Mass of molecular ion: 97)
Source Temperature: 260 °C Sample Temperature: 190 °C Reservoir, 75 eV
15.0 9.4 17.0 1.1 18.0 5.1 26.0 2.7 27.0 12.9 28.0 7.2 29.0 3.0 30.0 3.4 37.0 1.1 38.0 2.3 39.0 20.4 40.0 2.9 41.0 14.1 42.0 100.0 43.0 55.1 44.0 19.2 45.0 3.3 50.0 2.3 51.0 3.9 52.0 4.1 53.0 9.8 54.0 42.1 55.0 8.7 56.0 2.3 57.0 1.5 65.0 2.0 66.0 1.5 67.0 6.1 68.0 17.7 69.0 4.6 70.0 2.4 78.0 1.5 79.0 3.3 80.0 5.9 81.0 9.7 82.0 23.5 83.0 1.7 91.0 1.2 92.0 1.3 93.0 1.1 94.0 18.2 95.0 2.5 96.0 86.5 97.0 92.4 98.0 7.9
400 MHz in CDCl3
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1H NMR 399.65 MHz C6 H11 N 0.05 ml : 0.5 ml CDCl3 1-methyl-1,2,3,6-tetrahydropyridine 
Assign. Shift(ppm)
A 5.729 B 5.659 C 2.904 D 2.503 E 2.334 F 2.19
Hz ppm Int.1166.50 2.919 89 1163.45 2.912 211 1161.38 2.906 221 1160.52 2.904 241 1158.45 2.899 213 1155.52 2.892 89 1006.35 2.519 220 1000.61 2.504 412 994.87 2.490 255 935.79 2.342 103 932.98 2.335 1000 886.23 2.218 31 883.42 2.211 62 881.47 2.206 74 880.62 2.204 94 877.81 2.197 128 875.73 2.192 119 875.12 2.190 127 874.27 2.188 118 872.31 2.183 126 869.38 2.176 88 866.58 2.169 54
in CDCl3
liquid film
