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[bicyclohexyl]-4-one

View entire compound with spectra: 2 NMR, 1 FTIR, and 2 MS (GC)

[bicyclohexyl]-4-one
SpectraBase Compound ID DP43u3r7Pwa
InChI InChI=1S/C12H20O/c13-12-8-6-11(7-9-12)10-4-2-1-3-5-10/h10-11H,1-9H2
InChIKey JLYNSPSTPQAEAX-UHFFFAOYSA-N
Mol Weight 180.29 g/mol
Molecular Formula C12H20O
Exact Mass 180.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9McswLF26Qp
Name [1,1'-Bicyclohexyl]-4-one
Alternate Name(s) 4-Cyclohexylcyclohexanone 4-Cyclohexyl-1-cyclohexanone 4-Cyclohexylcyclohexan-1-one [1,1'-bi(cyclohexan)]-4-one C 66 AI3-04093 EINECS 202-178-7 NSC 22250
CAS Registry Number 92-68-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O
InChI InChI=1S/C12H20O/c13-12-8-6-11(7-9-12)10-4-2-1-3-5-10/h10-11H,1-9H2
InChIKey JLYNSPSTPQAEAX-UHFFFAOYSA-N
Molecular Weight 180.291 g/mol
SMILES C1(CCC(CC1)C1CCCCC1)=O
SPLASH splash10-0pc4-9100000000-7c69a52e646af1141844
Source of Spectrum JX-2015-6-2832
Wiley ID 1728412