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1-Heptanone, 2-(acetyloxy)-1-cyclohexyl-
SpectraBase Compound ID B9ZL7E1NGno
InChI InChI=1S/C15H26O3/c1-3-4-6-11-14(18-12(2)16)15(17)13-9-7-5-8-10-13/h13-14H,3-11H2,1-2H3
InChIKey XRLLHRFGYSMKPX-UHFFFAOYSA-N
Mol Weight 254.37 g/mol
Molecular Formula C15H26O3
Exact Mass 254.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LUd9efc27cS
Name 1-Heptanone, 2-(acetyloxy)-1-cyclohexyl-
Alternate Name(s) 1-(cyclohexylcarbonyl)hexyl acetate 2-Acetoxy-1-cyclohexyl-1-heptanone
CAS Registry Number 105824-03-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H26O3
InChI InChI=1S/C15H26O3/c1-3-4-6-11-14(18-12(2)16)15(17)13-9-7-5-8-10-13/h13-14H,3-11H2,1-2H3
InChIKey XRLLHRFGYSMKPX-UHFFFAOYSA-N
Molecular Weight 254.370 g/mol
SMILES C(C(OC(=O)C)CCCCC)(=O)C1CCCCC1
SPLASH splash10-01qc-9300000000-c9a0ac85e1576b212759
Source of Spectrum AJ-59-948-2
Wiley ID 1257968