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4-(3-Ketocyclohexyl)butyronitrile
SpectraBase Compound ID IbcnxE8tGZD
InChI InChI=1S/C10H15NO/c11-7-2-1-4-9-5-3-6-10(12)8-9/h9H,1-6,8H2
InChIKey LBNXUJAXQZAJIU-UHFFFAOYSA-N
Mol Weight 165.24 g/mol
Molecular Formula C10H15NO
Exact Mass 165.115364 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6d8KY97DoSe
Name 4-(3-Ketocyclohexyl)butyronitrile
CAS Registry Number 110718-80-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H15NO
InChI InChI=1S/C10H15NO/c11-7-2-1-4-9-5-3-6-10(12)8-9/h9H,1-6,8H2
InChIKey LBNXUJAXQZAJIU-UHFFFAOYSA-N
Molecular Weight 165.236 g/mol
SMILES C(#N)CCCC1CC(=O)CCC1
SPLASH splash10-00r2-9300000000-831adab3b438723946cc
Source of Spectrum F-45-451-0
Synonyms 4-(3-Oxidanylidenecyclohexyl)butanenitrile 4-(3-Oxocyclohexyl)butanenitrile
Wiley ID 1161656