3-乙基己烷(619-99-8)核磁图(13CNMR)
InChI:InChI=1S/C8H18/c1-4-7-8(5-2)6-3/h8H,4-7H2,1-3H3
InChIKey: SFRKSDZMZHIISH-UHFFFAOYSA-N
Smiles:CCC(CC)CCC
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Assign. Shift(ppm)
A 1.28
B 1.28
C 1.21
D 1.18
E 0.884
F 0.835
J(A,E) = 7 HZ.
J(B,F) = 7.4 HZ
Spectral Code: 1H NMR : 90 MHz in CDCl3
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ppm Int. Assign.
40.34 450 6
35.37 583 5
25.59 1000 4
20.06 512 3
14.55 526 2
10.93 948 1
Spectral Code: 13C NMR : in CDCl3
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Spectral Code: IR : liquid film