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Hydroxycitronellal diethyl acetal
SpectraBase Compound ID BBC6a1UUmdE
InChI InChI=1S/C14H30O3/c1-6-16-13(17-7-2)11-12(3)9-8-10-14(4,5)15/h12-13,15H,6-11H2,1-5H3
InChIKey XOJDKWNFMFCXNE-UHFFFAOYSA-N
Mol Weight 246.39 g/mol
Molecular Formula C14H30O3
Exact Mass 246.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AhoVa8WPB2O
Name Hydroxycitronellal diethyl acetal
Alternate Name(s) Hydroxy citronellal
CAS Registry Number 7779-94-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H30O3
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness)
GC Oven Program 60 ??C to 246 ??C at 3 ??C/min.
InChI InChI=1S/C14H30O3/c1-6-16-13(17-7-2)11-12(3)9-8-10-14(4,5)15/h12-13,15H,6-11H2,1-5H3
InChIKey XOJDKWNFMFCXNE-UHFFFAOYSA-N
Molecular Weight 246.391 g/mol
SMILES OC(C)(C)CCCC(C)CC(OCC)OCC
SPLASH splash10-0udm-9400000000-551b0d02d661680e71fb
Source ex BEDOUKIAN RES.
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID 1886463