Product Name2,3-DIMETHYL OCTANE
CAS7146-60-3
Molecular FormulaC10H22
Molecular Weight142.28
InChIInChI=1S/C10H22/c1-5-6-7-8-10(4)9(2)3/h9-10H,5-8H2,1-4H3
InChIKey YPMNDMUOGQJCLW-UHFFFAOYSA-N
SmilesCC(C)C(C)CCCCC
Assign. Shift(ppm)
A 1.54 B *1 1.30 C 1.28 D 1.27 E *1 1.07 F 0.887 G 0.853 J 0.796 K 0.786 THE SHIFT VALUES WERE OBTAINED AT 400MHZ. J(A,G)=6.8HZ. J(A,J)=6.8HZ. J(D,K)=6.7HZ.
ppm Int. Assign.
38.78 776 6 34.33 986 5 32.51 958 3 * 32.19 853 8 * 27.45 951 4 22.92 825 2 20.35 951 9 18.09 1000 9 15.45 951 7 14.18 874 1
2,3-DIMETHYL OCTANE(7146-60-3) 1H NMR Atlas of Related Products