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3-((tetrahydrofuran-2-yl)methyl)octan-2-one
SpectraBase Compound ID JsRLkS3AY9W
InChI InChI=1S/C13H24O2/c1-3-4-5-7-12(11(2)14)10-13-8-6-9-15-13/h12-13H,3-10H2,1-2H3
InChIKey UIBUJIHABDVKLT-UHFFFAOYSA-N
Mol Weight 212.33 g/mol
Molecular Formula C13H24O2
Exact Mass 212.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 62zOlh4IaXE
Name 3-((tetrahydrofuran-2-yl)methyl)octan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H24O2
InChI InChI=1S/C13H24O2/c1-3-4-5-7-12(11(2)14)10-13-8-6-9-15-13/h12-13H,3-10H2,1-2H3
InChIKey UIBUJIHABDVKLT-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 212.333 g/mol
SMILES CC(=O)C(CCCCC)CC1OCCC1
SPLASH splash10-00du-9000000000-e3cc24dc9c2344fa10ea
Sample Comments major, diastereomeric mixture (53:47)
Source of Spectrum US20100111888A1
Wiley ID 1842228