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3-(1-oxohexyl)-1-cyclohexanone
SpectraBase Compound ID 1Gpfn2wWXty
InChI InChI=1S/C12H20O2/c1-2-3-4-8-12(14)10-6-5-7-11(13)9-10/h10H,2-9H2,1H3
InChIKey AZUXRKREUPQODA-UHFFFAOYSA-N
Mol Weight 196.29 g/mol
Molecular Formula C12H20O2
Exact Mass 196.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9sSRpSF60nx
Name 3-(1-oxohexyl)-1-cyclohexanone
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O2
InChI InChI=1S/C12H20O2/c1-2-3-4-8-12(14)10-6-5-7-11(13)9-10/h10H,2-9H2,1H3
InChIKey AZUXRKREUPQODA-UHFFFAOYSA-N
Molecular Weight 196.290 g/mol
SMILES C1(C(=O)CCCCC)CC(=O)CCC1
SPLASH splash10-0006-9100000000-4d7372627597521a1ba3
Source of Spectrum CV-2002-2501-5
Synonyms 3-Caproylcyclohexanone 3-hexanoylcyclohexan-1-one 3-Hexanoylcyclohexanone
Wiley ID 1610501