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4-Octyl-2-oxo-6-phenyl-2H-pyran-5-carbonitrile

View entire compound with spectra: 1 MS (GC)

4-Octyl-2-oxo-6-phenyl-2H-pyran-5-carbonitrile
SpectraBase Compound ID 4TUyLB5aGVu
InChI InChI=1S/C20H23NO2/c1-2-3-4-5-6-8-13-17-14-19(22)23-20(18(17)15-21)16-11-9-7-10-12-16/h7,9-12,14H,2-6,8,13H2,1H3
InChIKey QZOIYPLKVBLRMN-UHFFFAOYSA-N
Mol Weight 309.41 g/mol
Molecular Formula C20H23NO2
Exact Mass 309.172879 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HRVQOyZx7t2
Name 4-Octyl-2-oxo-6-phenyl-2H-pyran-5-carbonitrile
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H23NO2
InChI InChI=1S/C20H23NO2/c1-2-3-4-5-6-8-13-17-14-19(22)23-20(18(17)15-21)16-11-9-7-10-12-16/h7,9-12,14H,2-6,8,13H2,1H3
InChIKey QZOIYPLKVBLRMN-UHFFFAOYSA-N
Molecular Weight 309.409 g/mol
SMILES C1(C=C(C(=C(O1)c1ccccc1)C#N)CCCCCCCC)=O
SPLASH splash10-03di-0091000000-97266285b2978013988f
Source of Spectrum F4-0-2734-3
Wiley ID 1620360