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Cyclododecanecarbonitrile, 2-oxo-1-(2-propenyl)-
SpectraBase Compound ID BYWsZcyRmEM
InChI InChI=1S/C16H25NO/c1-2-12-16(14-17)13-10-8-6-4-3-5-7-9-11-15(16)18/h2H,1,3-13H2
InChIKey JEFNBXUKLIUDJD-UHFFFAOYSA-N
Mol Weight 247.38 g/mol
Molecular Formula C16H25NO
Exact Mass 247.193614 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IT9iHCk6mDo
Name Cyclododecanecarbonitrile, 2-oxo-1-(2-propenyl)-
Alternate Name(s) 1-Allyl-2-oxocyclododecane-1-carbonitrile 1-Allyl-2-oxocyclododecanecarbonitrile
CAS Registry Number 104890-82-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H25NO
InChI InChI=1S/C16H25NO/c1-2-12-16(14-17)13-10-8-6-4-3-5-7-9-11-15(16)18/h2H,1,3-13H2
InChIKey JEFNBXUKLIUDJD-UHFFFAOYSA-N
Molecular Weight 247.382 g/mol
SMILES C1(C#N)(C(=O)CCCCCCCCCC1)CC=C
SPLASH splash10-0007-9300000000-52e06cb0d2587fc25dd2
Source of Spectrum H-68-1996-33
Wiley ID 1250257