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Methyl 4-oxo-3-phenyl-4-(4-(trifluoromethyl)phenyl)butanoate

View entire compound with spectra: 1 MS (GC)

Methyl 4-oxo-3-phenyl-4-(4-(trifluoromethyl)phenyl)butanoate
SpectraBase Compound ID LRrA1rAn8Qr
InChI InChI=1S/C18H15F3O3/c1-24-16(22)11-15(12-5-3-2-4-6-12)17(23)13-7-9-14(10-8-13)18(19,20)21/h2-10,15H,11H2,1H3
InChIKey ZQJGVQKDNQGTBK-UHFFFAOYSA-N
Mol Weight 336.31 g/mol
Molecular Formula C18H15F3O3
Exact Mass 336.097329 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2EIegrzpcHQ
Name Methyl 4-oxo-3-phenyl-4-(4-(trifluoromethyl)phenyl)butanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H15F3O3
InChI InChI=1S/C18H15F3O3/c1-24-16(22)11-15(12-5-3-2-4-6-12)17(23)13-7-9-14(10-8-13)18(19,20)21/h2-10,15H,11H2,1H3
InChIKey ZQJGVQKDNQGTBK-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol900813z
Molecular Weight 336.310 g/mol
SMILES c1cc(ccc1C(F)(F)F)C(C(c1ccccc1)CC(OC)=O)=O
SPLASH splash10-00di-0900000000-a328f0e916adbeeb871f
Source of Spectrum A1-11-2744/SM-17e
Wiley ID 1756832