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2-Hexyl-1,3-dioxolane
SpectraBase Compound ID 9Vlok6wKx2L
InChI InChI=1S/C9H18O2/c1-2-3-4-5-6-9-10-7-8-11-9/h9H,2-8H2,1H3
InChIKey DDSSJDFXTAYRNO-UHFFFAOYSA-N
Mol Weight 158.24 g/mol
Molecular Formula C9H18O2
Exact Mass 158.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KgpgIcAPmb
Name Heptanal acetal
CAS Registry Number 1708-34-5
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 158.130679818 u
Formula C9H18O2
InChI InChI=1S/C9H18O2/c1-2-3-4-5-6-9-10-7-8-11-9/h9H,2-8H2,1H3
InChIKey DDSSJDFXTAYRNO-UHFFFAOYSA-N
Molecular Weight 158.241 g/mol
Number of Peaks 50
RI1 1158
RI2 835
SMILES C1(OCCO1)CCCCCC
SPLASH splash10-00di-9000000000-e39c7cd2ec1944f2db7c
Sample Comments RI1: measured on SLB-5ms (Hydro) RI2: measured on SLB-5ms (FAMEs) RI3: measured on Supelcowax-10 (FAMEs) RI4: measured on Supelcowax-10 (FAEEs) RI5: measured on Equity-1 (Hydro)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms 1,3-Dioxolane, 2-hexyl-
Wiley ID LM_FFNSC3_1667