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4-Methyl-5-phenyl-5-(trifluoromethyl)tetrahydrofuran-2-one isomer
SpectraBase Compound ID IRXOm1qBEP
InChI InChI=1S/C12H11F3O2/c1-8-7-10(16)17-11(8,12(13,14)15)9-5-3-2-4-6-9/h2-6,8H,7H2,1H3
InChIKey PFAFLIUZJAXPFX-UHFFFAOYSA-N
Mol Weight 244.21 g/mol
Molecular Formula C12H11F3O2
Exact Mass 244.071114 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8GfwDo3BLGX
Name 4-Methyl-5-phenyl-5-(trifluoromethyl)tetrahydrofuran-2-one isomer
Alternate Name(s) 4-Methyl-5-phenyl-5-(trifluoromethyl)dihydro-2(3H)-furanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11F3O2
InChI InChI=1S/C12H11F3O2/c1-8-7-10(16)17-11(8,12(13,14)15)9-5-3-2-4-6-9/h2-6,8H,7H2,1H3
InChIKey PFAFLIUZJAXPFX-UHFFFAOYSA-N
Molecular Weight 244.213 g/mol
SMILES C1(C(F)(F)F)(OC(=O)CC1C)c1ccccc1
SPLASH splash10-056r-1900000000-f7b093afee80aed5c0dc
Source of Spectrum F4-0-2433-12
Wiley ID 1620147