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3,5-bis(trifluoromethyl)benzoic acid, tetrahydro-3-thienyl ester

View entire compound with spectra: 2 NMR, and 1 FTIR

3,5-bis(trifluoromethyl)benzoic acid, tetrahydro-3-thienyl ester
SpectraBase Compound ID E3yUQXJKnes
InChI InChI=1S/C13H10F6O2S/c14-12(15,16)8-3-7(4-9(5-8)13(17,18)19)11(20)21-10-1-2-22-6-10/h3-5,10H,1-2,6H2
InChIKey LAZVDVUUUPPLPG-UHFFFAOYSA-N
Mol Weight 344.27 g/mol
Molecular Formula C13H10F6O2S
Exact Mass 344.03057 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BsStudthnGF
Name 3,5-BIS(TRIFLUOROMETHYL)BENZOIC ACID, TETRAHYDRO-3-THIENYL ESTER
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H10F6O2S
InChI InChI=1S/C13H10F6O2S/c14-12(15,16)8-3-7(4-9(5-8)13(17,18)19)11(20)21-10-1-2-22-6-10/h3-5,10H,1-2,6H2
InChIKey LAZVDVUUUPPLPG-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 90-93C
Molecular Weight 344.28
Solvent CDCl3; Reference=TMS; Temperature 297K