5-Hydroxymethylfurfural(67-47-0) 1H NMR
Molecular FormulaC6H6O3
Molecular Weight126.11
InChIInChI=1S/C6H6O3/c7-3-5-1-2-6(4-8)9-5/h1-3,8H,4H2
InChIKey NOEGNKMFWQHSLB-UHFFFAOYSA-N
SmilesO1C(CO)=CC=C1C=O
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![](https://www.chemicalbook.com/Spectrum/67-47-0_1HNMR_0.jpg)
Parameter ppm Hz
D(A) 9.531
D(B) 7.230
D(C) 6.515
D(D) 4.690
J(B,C) 3.5
J(B,D) 0.0
J(C,D) 0.0
D(E) 3.73
Spectral Code: 1H NMR : parameter in CDCl3
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![](https://www.chemicalbook.com/Spectrum/67-47-0_13CNMR_0.jpg)
ppm Int. Assign.
178.00 978 1
161.44 1000 2
152.07 985 3
123.86 645 4
110.05 953 5
57.17 978 6
Spectral Code: 13C NMR : in CDCl3
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![](https://www.chemicalbook.com/Spectrum/67-47-0_IR1_0.jpg)
Spectral Code: IR : liquid film