N-METHYLOCTYLAMINE(2439-54-5) IR1
Product NameN-METHYLOCTYLAMINE
CAS2439-54-5
Molecular FormulaC9H21N
Molecular Weight143.27
InChIInChI=1S/C9H21N/c1-3-4-5-6-7-8-9-10-2/h10H,3-9H2,1-2H3
InChIKey SEGJNMCIMOLEDM-UHFFFAOYSA-N
SmilesC(NC)CCCCCCC
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MassMS-IW-3847 n-methyloctylamine C9H21N (Mass of molecular ion: 143)
Source Temperature: 220 °C Sample Temperature: 150 °C Reservoir, 75 eV
27.0 2.7 28.0 1.2 29.0 3.6 30.0 3.2 31.0 1.6 39.0 2.3 41.0 7.1 42.0 4.5 43.0 5.1 44.0 100.0 45.0 4.9 55.0 3.4 56.0 2.0 57.0 2.7 58.0 13.0 59.0 1.6 69.0 1.5 70.0 1.8 86.0 1.1 100.0 1.9 114.0 1.1 142.0 1.5 143.0 9.9 144.0 1.1
400 MHz in CDCl3
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1H NMR 399.65 MHz C9 H21 N 0.05 ml : 0.5 ml CDCl3 N-methyloctylamine 
Assign. Shift(ppm)
A 2.556 B 2.425 C 1.48 D 1.33 to 1.25 E 0.879
Hz ppm Int.1028.81 2.575 160 1021.73 2.557 255 1014.40 2.539 170 969.60 2.427 1000 958.74 2.399 24 604.86 1.514 30 604.61 1.513 30 597.90 1.497 92 595.70 1.491 83 590.94 1.479 144 583.86 1.461 119 576.78 1.444 52 516.24 1.292 632 510.01 1.277 535 358.52 0.898 207 351.81 0.881 581 344.73 0.863 239
in CDCl3
liquid film
