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Ethyl trans-4-(4-acetylphenyl)cyclohexane carboxylate
SpectraBase Compound ID 8zC6k51UwoD
InChI InChI=1S/C17H22O3/c1-3-20-17(19)16-10-8-15(9-11-16)14-6-4-13(5-7-14)12(2)18/h4-7,15-16H,3,8-11H2,1-2H3/t15-,16-
InChIKey DZCQEMFLTVJEEW-WKILWMFISA-N
Mol Weight 274.36 g/mol
Molecular Formula C17H22O3
Exact Mass 274.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FZdyLBcM2mK
Name Ethyl trans-4-(4-acetylphenyl)cyclohexane carboxylate
Alternate Name(s) (1r,4r)-ethyl 4-(4-acetylphenyl)cyclohexanecarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22O3
InChI InChI=1S/C17H22O3/c1-3-20-17(19)16-10-8-15(9-11-16)14-6-4-13(5-7-14)12(2)18/h4-7,15-16H,3,8-11H2,1-2H3/t15-,16-
InChIKey DZCQEMFLTVJEEW-WKILWMFISA-N
Literature Reference DOI 10.1021/ol403673e
Molecular Weight 274.360 g/mol
SMILES C1C[C@](CC[C@@]1(C(OCC)=O)[H])(c1ccc(cc1)C(=O)C)[H]
SPLASH splash10-0kmi-1490000000-2b7bb5f841417499b10a
Source of Spectrum A1-16-924/SM35-3ab
Wiley ID 1747712