顺-1,4-二甲基环己烷(624-29-3)核磁图(1HNMR)
InChI:InChI=1S/C8H16/c1-7-3-5-8(2)6-4-7/h7-8H,3-6H2,1-2H3/t7-,8+
InChIKey: QRMPKOFEUHIBNM-OCAPTIKFSA-N
Smiles:[C@@H]1(C)CC[C@H](C)CC1
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Assign. Shift(ppm)
A 1.80 to 1.05
B 0.906
J(A,B)=6.2HZ.
Spectral Code: 1H NMR : 90 MHz in CDCl3
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ppm Int. Assign.
30.81 1000 1
30.16 537 2
20.28 489 3
Spectral Code: 13C NMR : in CDCl3
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Spectral Code: IR : liquid film