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6-Methyl-2-octyl-1,3-dioxan-4-one
SpectraBase Compound ID BfCR7ThvWq
InChI InChI=1S/C13H24O3/c1-3-4-5-6-7-8-9-13-15-11(2)10-12(14)16-13/h11,13H,3-10H2,1-2H3
InChIKey XNOISOVRSLUQEF-UHFFFAOYSA-N
Mol Weight 228.33 g/mol
Molecular Formula C13H24O3
Exact Mass 228.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Df9UgneEWft
Name 1,3-DIOXAN-4-ONE, 6-METHYL-2-OCTYL-, (2R-cis)-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H24O3
InChI InChI=1S/C13H24O3/c1-3-4-5-6-7-8-9-13-15-11(2)10-12(14)16-13/h11,13H,3-10H2,1-2H3
InChIKey XNOISOVRSLUQEF-UHFFFAOYSA-N
Molecular Weight 228.1719
SMILES C1(C)CC(=O)OC(CCCCCCCC)O1
SPLASH splash10-014l-9100000000-3ec0257130e211280f8e
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany