D-Mannitol (69-65-8) IR1
Molecular FormulaC6H14O6
Molecular Weight182.17
InChIInChI=1S/C6H14O6/c7-1-3(9)5(11)6(12)4(10)2-8/h3-12H,1-2H2/t3-,4-,5-,6-/m1/s1
InChIKey FBPFZTCFMRRESA-KVTDHHQDSA-N
SmilesOC[C@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O
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![](https://www.chemicalbook.com/Spectrum/87-78-569-65-8_1HNMR_0.jpg)
Assign. Shift(ppm)
A 4.42
B 4.35
C 4.15
D 3.610
E 3.540
F 3.45
G 3.38
ASSIGNED BY H-H COSY.
J(A,F)=5.4HZ
J(B,D)=J(B,G)=5.7HZ
J(C,E)=7.1HZ
J(D,G)=-10.7HZ
J(D,F)=3.3HZ
J(G,F)=5.6HZ
Spectral Code: 1H NMR : 400 MHz in DMSO-d6
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![](https://www.chemicalbook.com/Spectrum/87-78-569-65-8_13CNMR_0.jpg)
ppm Int. Assign.
72.05 1000 1
70.48 984 2
64.36 994 3
Spectral Code: 13C NMR : in D2O
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![](https://www.chemicalbook.com/Spectrum/87-78-569-65-8_IR1_0.jpg)
Spectral Code: IR : nujol mull
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![](https://www.chemicalbook.com/Spectrum/87-78-569-65-8_Raman_0.jpg)
Spectral Code: Raman : 4880 A,200 M,powder