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3-(2-oxocyclohexyl)-1-adamantaneacetic acid ethylester
SpectraBase Compound ID Jx9bxvHqS4z
InChI InChI=1S/C20H30O3/c1-2-23-18(22)12-19-8-14-7-15(9-19)11-20(10-14,13-19)16-5-3-4-6-17(16)21/h14-16H,2-13H2,1H3/t14-,15+,16?,19-,20-
InChIKey XMOAZTDMLUYRFZ-HDNFDHTMSA-N
Mol Weight 318.46 g/mol
Molecular Formula C20H30O3
Exact Mass 318.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4BC4EKcon0p
Name 3-(2-oxocyclohexyl)-1-adamantaneacetic acid ethylester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H30O3
InChI InChI=1S/C20H30O3/c1-2-23-18(22)12-19-8-14-7-15(9-19)11-20(10-14,13-19)16-5-3-4-6-17(16)21/h14-16H,2-13H2,1H3/t14-,15+,16?,19-,20-
InChIKey XMOAZTDMLUYRFZ-HDNFDHTMSA-N
Molecular Weight 318.457 g/mol
SMILES C1[C@@]2(C[C@]3(C[C@]1(C[C@@](C2)(C3)C1CCCCC1=O)[H])CC(OCC)=O)[H]
SPLASH splash10-0002-0950000000-29d9c0da3c86ecd93b01
Source of Spectrum K-113-3755-71
Synonyms Ethyl 2-((1r,3s,5R,7S)-3-(2-oxocyclohexyl)adamantan-1-yl)acetate
Wiley ID 1792642