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Cyclohexanone, 2-acetyl-5-butyl-
SpectraBase Compound ID 8x9tM2rhDNe
InChI InChI=1S/C12H20O2/c1-3-4-5-10-6-7-11(9(2)13)12(14)8-10/h10-11H,3-8H2,1-2H3
InChIKey CHRWBQZVLRTIRN-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 K236cwQYAnH
Name Cyclohexanone, 2-acetyl-5-butyl-
Alternate Name(s) 2-Acetyl-5-butylcyclohexanone 2-Acetyl-5-n-butylcyclohexanone
CAS Registry Number 56745-72-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O2
InChI InChI=1S/C12H20O2/c1-3-4-5-10-6-7-11(9(2)13)12(14)8-10/h10-11H,3-8H2,1-2H3
InChIKey CHRWBQZVLRTIRN-UHFFFAOYSA-N
Molecular Weight 196.290 g/mol
SMILES C1(C(CCC(C1)CCCC)C(=O)C)=O
SPLASH splash10-0015-9700000000-a9c48ccc146045fdeceb
Source of Spectrum F-33-1109-0
Wiley ID 1193449