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(2,2-dimethyl-6-oxidanylidene-cyclohexyl) benzoate
SpectraBase Compound ID 3rTKYbWmOQs
InChI InChI=1S/C15H18O3/c1-15(2)10-6-9-12(16)13(15)18-14(17)11-7-4-3-5-8-11/h3-5,7-8,13H,6,9-10H2,1-2H3
InChIKey GBMOZAJRBMDNQG-UHFFFAOYSA-N
Mol Weight 246.31 g/mol
Molecular Formula C15H18O3
Exact Mass 246.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9ef2y2e9M79
Name (2,2-dimethyl-6-oxidanylidene-cyclohexyl) benzoate
CAS Registry Number 77256-23-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18O3
InChI InChI=1S/C15H18O3/c1-15(2)10-6-9-12(16)13(15)18-14(17)11-7-4-3-5-8-11/h3-5,7-8,13H,6,9-10H2,1-2H3
InChIKey GBMOZAJRBMDNQG-UHFFFAOYSA-N
Molecular Weight 246.306 g/mol
SMILES C(OC1C(CCCC1=O)(C)C)(=O)c1ccccc1
SPLASH splash10-0a4i-0920000000-8fea2b7d7e7b9a8ba59c
Source of Spectrum J-46-2720-0
Synonyms (2,2-dimethyl-6-oxo-cyclohexyl) benzoate benzoic acid (2,2-dimethyl-6-oxocyclohexyl) ester benzoic acid (6-keto-2,2-dimethyl-cyclohexyl) ester
Wiley ID 1249156