7-METHYL-3-OCTYNE(37050-06-9)核磁图(13CNMR)
InChI:InChI=1S/C9H16/c1-4-5-6-7-8-9(2)3/h9H,4,7-8H2,1-3H3
InChIKey: ZDXUMWBWHSCWBK-UHFFFAOYSA-N
Smiles:CCC#CCCC(C)C
-
Assign. Shift(ppm)
A 2.38 to 1.95
B 1.61
C 1.44
D 1.11
E 0.890
Spectral Code: 1H NMR : 90 MHz in CDCl3
-
ppm Int. Assign.
81.45 246 1
79.56 268 2
38.35 492 3
27.33 656 4
22.27 1000 5
16.84 617 6
14.46 475 7
12.52 590 8
Spectral Code: 13C NMR : in CDCl3
-
Spectral Code: IR : liquid film
-
Spectral Code: Raman : 4880 A,150M,liquid