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2-Propyl-4-methyl-1,3-dioxolane, mixture of isomers
SpectraBase Compound ID Gi4oRlFtrDj
InChI InChI=1S/C7H14O2/c1-3-4-7-8-5-6(2)9-7/h6-7H,3-5H2,1-2H3
InChIKey WRTYJFJOOTWPJP-UHFFFAOYSA-N
Mol Weight 130.19 g/mol
Molecular Formula C7H14O2
Exact Mass 130.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KBAZoFQBtjB
Name Butyraldehyde cyclic propylene acetal
Source of Sample SAFC Cat.no. W510866
CAS Registry Number 4352-99-2
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 130.099379689 u
Formula C7H14O2
InChI InChI=1S/C7H14O2/c1-3-4-7-8-5-6(2)9-7/h6-7H,3-5H2,1-2H3
InChIKey WRTYJFJOOTWPJP-UHFFFAOYSA-N
Molecular Weight 130.187 g/mol
Number of Peaks 45
RI1 879
RI2 543
RI3 513
RI4 465
SMILES C1C(OC(O1)CCC)C
SPLASH splash10-000l-9000000000-80ab0d226483d3eee401
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, 4-methyl-2-propyl-
Wiley ID LM_FFNSC3_416