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Cyclododecanecarbonitrile, 2-oxo-1-(2-oxopropyl)-

View entire compound with spectra: 1 MS (GC)

Cyclododecanecarbonitrile, 2-oxo-1-(2-oxopropyl)-
SpectraBase Compound ID 529CliTFUYG
InChI InChI=1S/C16H25NO2/c1-14(18)12-16(13-17)11-9-7-5-3-2-4-6-8-10-15(16)19/h2-12H2,1H3
InChIKey GQEQSUDLKUSODH-UHFFFAOYSA-N
Mol Weight 263.38 g/mol
Molecular Formula C16H25NO2
Exact Mass 263.188529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CPAMGmUtUIy
Name Cyclododecanecarbonitrile, 2-oxo-1-(2-oxopropyl)-
Alternate Name(s) 1-Acetonyl-2-oxocyclododecane-1-carbonitrile 2-Oxo-1-(2-oxopropyl)cyclododecanecarbonitrile
CAS Registry Number 104890-84-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H25NO2
InChI InChI=1S/C16H25NO2/c1-14(18)12-16(13-17)11-9-7-5-3-2-4-6-8-10-15(16)19/h2-12H2,1H3
InChIKey GQEQSUDLKUSODH-UHFFFAOYSA-N
Molecular Weight 263.381 g/mol
SMILES C1(C#N)(C(=O)CCCCCCCCCC1)CC(=O)C
SPLASH splash10-0006-9210000000-94a585f98bf9bffa6d39
Source of Spectrum H-68-1996-35
Wiley ID 1267071