2,4,4-TRIMETHYL-1-PENTANOL(16325-63-6) IR1
Product Name2,4,4-TRIMETHYL-1-PENTANOL
CAS16325-63-6
Molecular FormulaC8H18O
Molecular Weight130.23
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MassMS-NW-7576 2,4,4-trimethyl-1-pentanol C8H18O (Mass of molecular ion: 130)
Source Temperature: 260 °C Sample Temperature: 170 °C Reservoir, 75 eV
27.0 4.4 28.0 1.0 29.0 11.5 31.0 5.6 39.0 5.3 41.0 26.9 42.0 1.9 43.0 12.4 45.0 1.3 53.0 1.5 55.0 29.0 56.0 32.5 57.0 100.0 58.0 4.6 59.0 2.4 69.0 6.4 70.0 1.3 71.0 2.2 72.0 1.9 73.0 8.8 97.0 18.2 98.0 1.5 115.0 1.9
400 MHz in CDCl3
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1H NMR 399.65 MHz C8 H18 O 0.05 ml : 0.5 ml CDCl3 2,4,4-trimethyl-1-pentanol 
Assign. Shift(ppm)
A *1 3.449 B *1 3.299 C 2.38 D 1.665 E *2 1.256 F *2 0.978 G 0.972 J 0.908 J(A,B)=-10.4HZ J(A,D)=5.6HZ J(B,D)=8.0HZ J(E,F)=-14.4HZ J(E,D)=4.0HZ J(F,D)=6.4HZ
Hz ppm Int.1318.97 3.301 31 950.20 2.378 48 511.47 1.280 53 507.69 1.271 51 497.44 1.245 67 493.77 1.236 64 404.66 1.013 83 398.32 0.997 85 391.97 0.981 392 385.25 0.964 385 362.92 0.909 1000
in CDCl3
liquid film
