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(S)-2-Methyl-4-(4-(trifluoromethyl)phenyl)pentan-3-one
SpectraBase Compound ID JcU0hUhOkd0
InChI InChI=1S/C13H15F3O/c1-8(2)12(17)9(3)10-4-6-11(7-5-10)13(14,15)16/h4-9H,1-3H3/t9-/m0/s1
InChIKey WGHDHQXEWNUSHF-VIFPVBQESA-N
Mol Weight 244.26 g/mol
Molecular Formula C13H15F3O
Exact Mass 244.1075 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 11DknP3HXSm
Name (S)-2-Methyl-4-(4-(trifluoromethyl)phenyl)pentan-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15F3O
InChI InChI=1S/C13H15F3O/c1-8(2)12(17)9(3)10-4-6-11(7-5-10)13(14,15)16/h4-9H,1-3H3/t9-/m0/s1
InChIKey WGHDHQXEWNUSHF-VIFPVBQESA-N
Literature Reference DOI 10.1021/acs.orglett.5b02370
Molecular Weight 244.257 g/mol
SMILES CC(C([C@@](C)(c1ccc(cc1)C(F)(F)F)[H])=O)C
SPLASH splash10-000x-6900000000-4b0450ad32ec765ce331
Source of Spectrum A1-17-4810/SM18-2y
Wiley ID 1802520