BUTYLAMINE HYDROCHLORIDE(3858-78-4) IR1
Product NameBUTYLAMINE HYDROCHLORIDE
CAS3858-78-4
Molecular FormulaC4H12ClN
Molecular Weight109.6
InChIInChI=1S/C4H11N.ClH/c1-2-3-4-5;/h2-5H2,1H3;1H
InChIKey ICXXXLGATNSZAV-UHFFFAOYSA-N
SmilesC(CN)CC.Cl
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MassMS-NW-2306 butylamine hydrochloride C4H11N HCl (Mass of molecular ion: 73)
Source Temperature: 220 °C Sample Temperature: 160 °C Direct, 75 eV
18.0 2.4 27.0 3.2 28.0 4.1 29.0 1.9 30.0 100.0 31.0 1.9 35.0 2.0 36.0 16.9 38.0 5.4 39.0 1.8 41.0 2.6 42.0 1.5 43.0 1.0 44.0 1.6 73.0 7.6
90 MHz in CDCl3
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1H NMR 89.56 MHz C4 H11 N 0.043 g : 0.5 ml CDCl3 butylamine hydrochloride 
Assign. Shift(ppm)
A 8.2 B 3.0 C 1.81 D 1.45 E 0.97
Hz ppm Int.732.06 8.174 149 270.38 3.019 166 175.75 1.963 50 175.44 1.959 53 173.88 1.942 42 173.19 1.934 38 168.88 1.886 118 168.50 1.882 119 166.31 1.857 117 165.88 1.853 118 161.06 1.799 179 160.38 1.791 176 158.06 1.765 136 157.63 1.761 136 157.25 1.756 137 156.06 1.743 132 155.38 1.735 137 152.44 1.703 153 146.50 1.636 136 144.31 1.612 66 143.50 1.603 64 139.56 1.559 145 137.25 1.533 69 132.69 1.482 177 132.31 1.478 180 127.94 1.429 127 126.56 1.414 146 126.38 1.412 146 125.06 1.397 168 118.44 1.323 129 111.75 1.248 54 92.50 1.033 577 85.94 0.960 1000 79.63 0.890 190 78.56 0.878 241 77.25 0.863 130 76.94 0.860 134
in CDCl3
KBr disc
liquid film
nujol mull
4880 A,200 M,powder
