N-TERT-BUTYLACRYLAMIDE(107-58-4) IR1
Product NameN-TERT-BUTYLACRYLAMIDE
CAS107-58-4
Molecular FormulaC7H13NO
Molecular Weight127.18
InChIInChI=1S/C7H13NO/c1-5-6(9)8-7(2,3)4/h5H,1H2,2-4H3,(H,8,9)
InChIKey XFHJDMUEHUHAJW-UHFFFAOYSA-N
SmilesC(NC(C)(C)C)(=O)C=C
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MassMS-KW-0259 N-tert-butylacrylamide C7H13NO (Mass of molecular ion: 127)
Source Temperature: 230 °C Sample Temperature: 150 °C Reservoir, 75 eV
15.0 1.8 26.0 1.6 27.0 14.5 28.0 3.5 29.0 5.4 30.0 1.0 39.0 4.0 40.0 1.0 41.0 12.5 42.0 5.4 44.0 1.2 53.0 1.5 54.0 1.4 55.0 47.1 56.0 9.9 57.0 11.8 58.0 100.0 59.0 3.9 72.0 32.7 73.0 1.2 84.0 1.4 112.0 19.6 113.0 1.4 127.0 14.2 128.0 1.4
400 MHz in CDCl3
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1H NMR 399.65 MHz C7H13NO 0.041 g : 0.5 ml CDCl3 N-tert-butylacrylamide 
Assign. Shift(ppm)
A 6.208 B 6.113 C 5.9 D 5.545 E 1.393
Hz ppm Int.2494.15 6.239 44 2492.31 6.235 48 2477.30 6.197 103 2475.35 6.192 94 2454.11 6.139 85 2444.22 6.114 88 2437.26 6.097 36 2427.25 6.072 44 2368.29 5.924 13 2222.42 5.560 75 2220.46 5.555 70 2212.41 5.535 67 2210.58 5.530 64 618.90 1.549 7 556.65 1.393 1000 492.44 1.232 7
in CDCl3
KBr disc
nujol mull
