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t-Butyl 3-oxo-3-cyclohexylpropionate
SpectraBase Compound ID 4u0T9kKTjZR
InChI InChI=1S/C13H22O3/c1-13(2,3)16-12(15)9-11(14)10-7-5-4-6-8-10/h10H,4-9H2,1-3H3
InChIKey PDMYKIIUCQGUMS-UHFFFAOYSA-N
Mol Weight 226.32 g/mol
Molecular Formula C13H22O3
Exact Mass 226.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gue7lgQSqt4
Name t-Butyl 3-oxo-3-cyclohexylpropionate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H22O3
InChI InChI=1S/C13H22O3/c1-13(2,3)16-12(15)9-11(14)10-7-5-4-6-8-10/h10H,4-9H2,1-3H3
InChIKey PDMYKIIUCQGUMS-UHFFFAOYSA-N
Molecular Weight 226.316 g/mol
SMILES C(CC(C1CCCCC1)=O)(=O)OC(C)(C)C
SPLASH splash10-0uk9-9420000000-eda322ce740f163435ff
Source of Spectrum F5-2-1507-14d
Synonyms tert-Butyl 3-cyclohexyl-3-oxopropanoate
Wiley ID 1731870