N-Isopropylacrylamide(2210-25-5) 13C NMR
Product NameN-Isopropylacrylamide
CAS2210-25-5
Molecular FormulaC6H11NO
Molecular Weight113.16
InChIInChI=1S/C6H11NO/c1-4-6(8)7-5(2)3/h4-5H,1H2,2-3H3,(H,7,8)
InChIKey QNILTEGFHQSKFF-UHFFFAOYSA-N
SmilesC(NC(C)C)(=O)C=C
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MassMS-NW-9462 n-isopropylacrylamide C6H11NO (Mass of molecular ion: 113)
Source Temperature: 250 °C Sample Temperature: 160 °C Reservoir, 75 eV
15.0 1.9 18.0 3.0 26.0 2.3 27.0 25.2 28.0 6.1 29.0 1.0 30.0 1.7 39.0 3.9 40.0 1.3 41.0 11.4 42.0 9.5 43.0 17.6 44.0 92.0 45.0 3.0 53.0 1.1 54.0 2.2 55.0 100.0 56.0 5.3 57.0 2.7 58.0 17.9 69.0 1.1 70.0 3.3 71.0 1.0 72.0 5.3 84.0 4.4 85.0 3.7 98.0 58.4 99.0 3.5 112.0 3.2 113.0 13.9 114.0 3.4
400 MHz in CDCl3
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1H NMR 399.65 MHz C6 H11 N O 0.036 g : 0.5 ml CDCl3 N-isopropylacrylamide 
Assign. Shift(ppm)
A 6.257 B 6.2 C 6.155 D 5.602 E 4.156 F 1.187
Hz ppm Int.2513.06 6.289 82 2511.23 6.284 90 2496.09 6.246 186 2494.26 6.242 180 2470.58 6.182 171 2460.57 6.157 173 2453.61 6.140 76 2443.48 6.115 86 2244.63 5.617 131 2242.80 5.612 127 2234.62 5.592 119 2232.79 5.587 124 1671.88 4.184 46 1665.28 4.167 64 1663.82 4.164 51 1658.69 4.151 52 1657.35 4.148 64 1650.76 4.131 47 477.91 1.196 1000 471.19 1.180 975
in CDCl3
KBr disc
nujol mull
