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4,4-Bis(ethylsulfanyl)-2-phenyl-3-trifluoromethyl-3-butenoic acid

View entire compound with spectra: 1 MS (GC)

4,4-Bis(ethylsulfanyl)-2-phenyl-3-trifluoromethyl-3-butenoic acid
SpectraBase Compound ID 8GRlZWKhCBd
InChI InChI=1S/C15H17F3O2S2/c1-3-21-14(22-4-2)12(15(16,17)18)11(13(19)20)10-8-6-5-7-9-10/h5-9,11H,3-4H2,1-2H3,(H,19,20)
InChIKey QVMQRYPUGJDNTA-UHFFFAOYSA-N
Mol Weight 350.41 g/mol
Molecular Formula C15H17F3O2S2
Exact Mass 350.062207 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1oZ0cHzhh2
Name 4,4-Bis(ethylsulfanyl)-2-phenyl-3-trifluoromethyl-3-butenoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H17F3O2S2
InChI InChI=1S/C15H17F3O2S2/c1-3-21-14(22-4-2)12(15(16,17)18)11(13(19)20)10-8-6-5-7-9-10/h5-9,11H,3-4H2,1-2H3,(H,19,20)
InChIKey QVMQRYPUGJDNTA-UHFFFAOYSA-N
Molecular Weight 350.414 g/mol
SMILES OC(C(C(=C(SCC)SCC)C(F)(F)F)c1ccccc1)=O
SPLASH splash10-0fba-0693000000-9df21c458204359c8268
Source of Spectrum KC-61-4399-3
Wiley ID 1629001