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Ethyl 3-methyl-2-(phenylthio)-2-(trifluoromethyl)-4-pentenoate
SpectraBase Compound ID FH5leo9US0M
InChI InChI=1S/C15H17F3O2S/c1-4-11(3)14(15(16,17)18,13(19)20-5-2)21-12-9-7-6-8-10-12/h4,6-11H,1,5H2,2-3H3
InChIKey KHYIIULYBJCCCY-UHFFFAOYSA-N
Mol Weight 318.35 g/mol
Molecular Formula C15H17F3O2S
Exact Mass 318.090135 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bzke4R8Mjbd
Name Ethyl 3-methyl-2-(phenylthio)-2-(trifluoromethyl)-4-pentenoate
Alternate Name(s) Ethyl 3-methyl-2-(phenylsulfanyl)-2-(trifluoromethyl)-4-pentenoate
CAS Registry Number 134427-81-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H17F3O2S
InChI InChI=1S/C15H17F3O2S/c1-4-11(3)14(15(16,17)18,13(19)20-5-2)21-12-9-7-6-8-10-12/h4,6-11H,1,5H2,2-3H3
InChIKey KHYIIULYBJCCCY-UHFFFAOYSA-N
Molecular Weight 318.354 g/mol
SMILES C(C(F)(F)F)(C(=O)OCC)(Sc1ccccc1)C(C=C)C
SPLASH splash10-0a4i-6921000000-861f93617c3d792e38aa
Source of Spectrum F-47-1639-6
Wiley ID 1318194