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5-Hydroxymethylfurfural

View entire compound with spectra: 9 NMR, 8 FTIR, 1 Raman, 2 UV-Vis, and 24 MS (GC)

5-Hydroxymethylfurfural
SpectraBase Compound ID 6vgE2q20d6d
InChI InChI=1S/C6H6O3/c7-3-5-1-2-6(4-8)9-5/h1-3,8H,4H2
InChIKey NOEGNKMFWQHSLB-UHFFFAOYSA-N
Mol Weight 126.11 g/mol
Molecular Formula C6H6O3
Exact Mass 126.031694 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GuSTfDyvvQs
Name 5-HYDROXYMETHYLFURFURAL
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C6H6O3
InChI InChI=1S/C6H6O3/c7-3-5-1-2-6(4-8)9-5/h1-3,8H,4H2
InChIKey NOEGNKMFWQHSLB-UHFFFAOYSA-N
Literature Reference Author W.A.AYER,J.S.RACOK
Literature Reference Citation CAN.J.CHEM.,68,2085(1990)
Literature Reference DOI 10.1139/v90-318
Molecular Weight 126.112 g/mol
Solvent ACETONE-D6
Source File Reference UWCS11564