Product Name3,3-Dimethyloctane
CAS4110-44-5
Molecular FormulaC10H22
Molecular Weight142.28
InChIInChI=1S/C10H22/c1-5-7-8-9-10(3,4)6-2/h5-9H2,1-4H3
InChIKey DBULLUBYDONGLT-UHFFFAOYSA-N
SmilesCCC(C)(C)CCCCC
Assign. Shift(ppm)
A 1.30 B 1.21 C 1.206 D 1.15 E 0.886 F 0.806 G 0.789 J(A,E) = 7.15 HZ. J(C,G) = 7.6 HZ.
ppm Int. Assign.
41.65 416 5 34.23 489 7 33.10 395 3 32.73 268 6 26.80 1000 9 23.82 437 4 22.88 368 2 14.16 337 1 8.43 363 8
3,3-Dimethyloctane(4110-44-5) 1H NMR Atlas of Related Products