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3-Methyl-2(5H)-furanone
SpectraBase Compound ID BPjiIG1Es4u
InChI InChI=1S/C5H6O2/c1-4-2-3-7-5(4)6/h2H,3H2,1H3
InChIKey VGHBEMPMIVEGJP-UHFFFAOYSA-N
Mol Weight 98.1 g/mol
Molecular Formula C5H6O2
Exact Mass 98.036779 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DdzM3ZUf1uC
Name 3-Methyl-2(5H)-furanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H6O2
InChI InChI=1S/C5H6O2/c1-4-2-3-7-5(4)6/h2H,3H2,1H3
InChIKey VGHBEMPMIVEGJP-UHFFFAOYSA-N
Instrument Name Finnigan GC/MS-4023 or VG-7070E
Ionization Type EI
Literature Reference DOI 10.1021/np0400860
Molecular Weight 98.101 g/mol
SMILES CC=1C(OCC1)=O
SPLASH splash10-014j-9000000000-a15c4eb482737871f3bb
Source of Spectrum G4-67-1384-5
Thin-Layer Chromatography Rf = 0.34 (Et2O/pentane, 3:1)
Wiley ID 1884049