(S)-(+)-2-辛醇
产品名称
(S)-(+)-2-辛醇
CAS号6169-06-8
分子式C8H18O
分子量130.23
InChIInChI=1S/C8H18O/c1-3-4-5-6-7-8(2)9/h8-9H,3-7H2,1-2H3/t8-/m0/s1
InChIKeySJWFXCIHNDVPSH-QMMMGPOBSA-N
SmilesC[C@H](O)CCCCCC
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Assign. Shift(ppm)
A 3.773
B 2.10
C 1.42
D 1.36
E 1.208
F 1.139
G 0.89
Spectral Code: 1H NMR : 90 MHz in CDCl3
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ppm Int. Assign.
68.11 950 1
39.42 955 2
31.92 896 3
29.41 910 4
25.81 1000 5
23.43 701 6
22.66 920 7
14.09 697 8
Spectral Code: 13C NMR : in CDCl3
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Spectral Code: IR : liquid film
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