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Cycloundecanecarboxylic acid, 9-cyano-2-oxo-, methyl ester
SpectraBase Compound ID FJODv0MYKcZ
InChI InChI=1S/C14H21NO3/c1-18-14(17)12-9-8-11(10-15)6-4-2-3-5-7-13(12)16/h11-12H,2-9H2,1H3
InChIKey HMGOVNVKCOKPJU-UHFFFAOYSA-N
Mol Weight 251.33 g/mol
Molecular Formula C14H21NO3
Exact Mass 251.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ByVvDdgzaRe
Name Cycloundecanecarboxylic acid, 9-cyano-2-oxo-, methyl ester
CAS Registry Number 104891-02-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H21NO3
InChI InChI=1S/C14H21NO3/c1-18-14(17)12-9-8-11(10-15)6-4-2-3-5-7-13(12)16/h11-12H,2-9H2,1H3
InChIKey HMGOVNVKCOKPJU-UHFFFAOYSA-N
Molecular Weight 251.326 g/mol
SMILES C1(C(=O)OC)C(=O)CCCCCCC(C#N)CC1
SPLASH splash10-0a4i-9820000000-cf0aef273d8846250565
Source of Spectrum H-68-1992-17
Synonyms Methyl 9-cyano-2-oxocycloundecanecarboxylate
Wiley ID 1254580