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2-Cyano-5-tridecyl-1,4-dioxane

View entire compound with spectra: 1 MS (GC)

2-Cyano-5-tridecyl-1,4-dioxane
SpectraBase Compound ID 5FWg56XVo2j
InChI InChI=1S/C18H33NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-15-21-18(14-19)16-20-17/h17-18H,2-13,15-16H2,1H3
InChIKey WROKCLFQSVGZRB-UHFFFAOYSA-N
Mol Weight 295.5 g/mol
Molecular Formula C18H33NO2
Exact Mass 295.251129 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9TnCFq5rUQ2
Name 2-Cyano-5-tridecyl-1,4-dioxane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H33NO2
InChI InChI=1S/C18H33NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-17-15-21-18(14-19)16-20-17/h17-18H,2-13,15-16H2,1H3
InChIKey WROKCLFQSVGZRB-UHFFFAOYSA-N
Molecular Weight 295.467 g/mol
SMILES C(#N)C1OCC(OC1)CCCCCCCCCCCCC
SPLASH splash10-052f-9000000000-77abc4f2dbacc46491a9
Source of Spectrum C5-2002-2134-10
Synonyms 5-tridecyl-1,4-dioxane-2-carbonitrile
Wiley ID 1615102