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(3-Benzoyl-4,4-dimethylcyclohexane-1,1-diyl)bis(methylene) diacetate
SpectraBase Compound ID 6Qf0n2Yhbfj
InChI InChI=1S/C21H28O5/c1-15(22)25-13-21(14-26-16(2)23)11-10-20(3,4)18(12-21)19(24)17-8-6-5-7-9-17/h5-9,18H,10-14H2,1-4H3
InChIKey KWIMVWHMDZDCNH-UHFFFAOYSA-N
Mol Weight 360.45 g/mol
Molecular Formula C21H28O5
Exact Mass 360.193674 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EFX7PS0Q0vP
Name (3-Benzoyl-4,4-dimethylcyclohexane-1,1-diyl)bis(methylene) diacetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H28O5
InChI InChI=1S/C21H28O5/c1-15(22)25-13-21(14-26-16(2)23)11-10-20(3,4)18(12-21)19(24)17-8-6-5-7-9-17/h5-9,18H,10-14H2,1-4H3
InChIKey KWIMVWHMDZDCNH-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201300253
Molecular Weight 360.450 g/mol
SMILES C(C1(CCC(C(C1)C(=O)c1ccccc1)(C)C)COC(=O)C)OC(=O)C
SPLASH splash10-0zfu-0739000000-f37aa157d72965ed980f
Source of Spectrum ASC-355-1943/SM10-5l
Wiley ID 1761586