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5-Methylfurfural
SpectraBase Compound ID LS4YMgSWtjr
InChI InChI=1S/C6H6O2/c1-5-2-3-6(4-7)8-5/h2-4H,1H3
InChIKey OUDFNZMQXZILJD-UHFFFAOYSA-N
Mol Weight 110.11 g/mol
Molecular Formula C6H6O2
Exact Mass 110.036779 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9Kpz4iE8BgR
Name 5-Methyl furfural
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 110.036779431 u
Formula C6H6O2
InChI InChI=1S/C6H6O2/c1-5-2-3-6(4-7)8-5/h2-4H,1H3
InChIKey OUDFNZMQXZILJD-UHFFFAOYSA-N
Instrument Name Agilent 6890N GC-5973 MS
Ionization Type EI
Literature Reference DOI 10.1002/anie.202211461
Molecular Weight 110.112 g/mol
Quality 414
SMILES C=1C=C(OC1C=O)C
SPLASH splash10-0nmi-6900000000-4db224e5ef71388477d6
Source of Spectrum ACI-62-SM12-MF (DOI: 10.1002/anie.202211461)
Wiley ID 1908400