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3-(5-Pivaloxypentyl)-2-cyclohexen-1-one
SpectraBase Compound ID qRBZTJZow0
InChI InChI=1S/C16H26O3/c1-16(2,3)15(18)19-11-6-4-5-8-13-9-7-10-14(17)12-13/h12H,4-11H2,1-3H3
InChIKey UXFWXSRFWIVKTM-UHFFFAOYSA-N
Mol Weight 266.38 g/mol
Molecular Formula C16H26O3
Exact Mass 266.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2nnhDd4CP7y
Name 3-(5-Pivaloxypentyl)-2-cyclohexen-1-one
Alternate Name(s) 5-(3-oxo-1-cyclohexen-1-yl)pentyl pivalate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H26O3
InChI InChI=1S/C16H26O3/c1-16(2,3)15(18)19-11-6-4-5-8-13-9-7-10-14(17)12-13/h12H,4-11H2,1-3H3
InChIKey UXFWXSRFWIVKTM-UHFFFAOYSA-N
Molecular Weight 266.381 g/mol
SMILES C(C(C)(C)C)(=O)OCCCCCC1=CC(=O)CCC1
SPLASH splash10-0a4i-9300000000-996a3b9ca47644849dba
Source of Spectrum J-61-8238-28
Wiley ID 1270408