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5-Methyl-2-octyl-3(2H)-furanone

View entire compound with spectra: 5 MS (GC)

5-Methyl-2-octyl-3(2H)-furanone
SpectraBase Compound ID DsFperPmBpa
InChI InChI=1S/C13H22O2/c1-3-4-5-6-7-8-9-13-12(14)10-11(2)15-13/h10,13H,3-9H2,1-2H3
InChIKey ZLLDSWALGJWTSW-UHFFFAOYSA-N
Mol Weight 210.32 g/mol
Molecular Formula C13H22O2
Exact Mass 210.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9dfcWrsUjWE
Name 3(2H)-FURANONE, 5-METHYL-2-OCTYL-
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 210.161979946 u
Formula C13H22O2
InChI InChI=1S/C13H22O2/c1-3-4-5-6-7-8-9-13-12(14)10-11(2)15-13/h10,13H,3-9H2,1-2H3
InChIKey ZLLDSWALGJWTSW-UHFFFAOYSA-N
Molecular Weight 210.317 g/mol
Nominal Mass 210 u
Number of Peaks 58
SMILES C(CCCCCC)CC1OC(C)=CC1=O
SPLASH splash10-01ot-9300000000-95793deb0dee07390462
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany
Wiley ID MVX000627