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Oxacyclohexadecane-5-carbonitrile, 2-methyl-16-oxo-
SpectraBase Compound ID AfrSqfSSYby
InChI InChI=1S/C17H29NO2/c1-15-12-13-16(14-18)10-8-6-4-2-3-5-7-9-11-17(19)20-15/h15-16H,2-13H2,1H3
InChIKey DOQBZKNPBLCNBQ-UHFFFAOYSA-N
Mol Weight 279.42 g/mol
Molecular Formula C17H29NO2
Exact Mass 279.219829 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GGJBQ3VsYy2
Name Oxacyclohexadecane-5-carbonitrile, 2-methyl-16-oxo-
Alternate Name(s) 12-Cyano-15-hexadecanolide 2-Methyl-16-oxooxacyclohexadecane-5-carbonitrile
CAS Registry Number 106943-69-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H29NO2
InChI InChI=1S/C17H29NO2/c1-15-12-13-16(14-18)10-8-6-4-2-3-5-7-9-11-17(19)20-15/h15-16H,2-13H2,1H3
InChIKey DOQBZKNPBLCNBQ-UHFFFAOYSA-N
Molecular Weight 279.424 g/mol
SMILES C(#N)C1CCC(OC(=O)CCCCCCCCCC1)C
SPLASH splash10-052e-9110000000-1931ea3691ef6c42fa7b
Source of Spectrum H-68-2117-6
Wiley ID 1283130