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2-cyclohexyl-4-oxopentanenitrile
SpectraBase Compound ID 8Y4ZR4lt8D5
InChI InChI=1S/C11H17NO/c1-9(13)7-11(8-12)10-5-3-2-4-6-10/h10-11H,2-7H2,1H3
InChIKey JMUFPIUEIUAAML-UHFFFAOYSA-N
Mol Weight 179.26 g/mol
Molecular Formula C11H17NO
Exact Mass 179.131014 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2CEWgqWfAYn
Name 2-cyclohexyl-4-oxopentanenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H17NO
InChI InChI=1S/C11H17NO/c1-9(13)7-11(8-12)10-5-3-2-4-6-10/h10-11H,2-7H2,1H3
InChIKey JMUFPIUEIUAAML-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201600287
Molecular Weight 179.263 g/mol
SMILES C(C(CC(C)=O)C1CCCCC1)#N
SPLASH splash10-0kmi-9300000000-1974775c5621e15bb835
Source of Spectrum ASC-358-2134/SM8-3e
Wiley ID 1807438