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Cyclododecanecarbonitrile, 2-oxo-1-(3-oxopropyl)-
SpectraBase Compound ID 9otVwWd2ge5
InChI InChI=1S/C16H25NO2/c17-14-16(12-9-13-18)11-8-6-4-2-1-3-5-7-10-15(16)19/h13H,1-12H2
InChIKey WZZYZCWZAVJANU-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 3BX9nHRF2Ar
Name Cyclododecanecarbonitrile, 2-oxo-1-(3-oxopropyl)-
CAS Registry Number 104951-29-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H25NO2
InChI InChI=1S/C16H25NO2/c17-14-16(12-9-13-18)11-8-6-4-2-1-3-5-7-10-15(16)19/h13H,1-12H2
InChIKey WZZYZCWZAVJANU-UHFFFAOYSA-N
Molecular Weight 263.381 g/mol
SMILES C1(C#N)(C(=O)CCCCCCCCCC1)CCC=O
SPLASH splash10-0a4i-9300000000-a12f763818e6ccfdbf8c
Source of Spectrum H-68-2117-2
Synonyms 2-Oxo-1-(3-oxopropyl)cyclododecanecarbonitrile 2-Oxo-1-(3-oxopropyl)-1-cyclododecanecarbonitrile 2-Oxo-1-(3-oxopropyl)cyclododecane-1-carbonitrile 2-Oxidanylidene-1-(3-oxidanylidenepropyl)cyclododecane-1-carbonitrile
Wiley ID 1267070