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TRANS-1,1,1-TRIFLUORO-4-(2-THIENYL)-3-BUTEN-2-METHYL-2-OL

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TRANS-1,1,1-TRIFLUORO-4-(2-THIENYL)-3-BUTEN-2-METHYL-2-OL
SpectraBase Compound ID AJ8SlGcWdem
InChI InChI=1S/C9H9F3OS/c1-8(13,9(10,11)12)5-4-7-3-2-6-14-7/h2-6,13H,1H3/b5-4+
InChIKey MQBWYBLKUANZCB-SNAWJCMRSA-N
Mol Weight 222.23 g/mol
Molecular Formula C9H9F3OS
Exact Mass 222.032621 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7ofXTLTzXSj
Name TRANS-1,1,1-TRIFLUORO-4-(2-THIENYL)-3-BUTEN-2-METHYL-2-OL
Compound Number 3E
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H9F3OS
InChI InChI=1S/C9H9F3OS/c1-8(13,9(10,11)12)5-4-7-3-2-6-14-7/h2-6,13H,1H3/b5-4+
InChIKey MQBWYBLKUANZCB-SNAWJCMRSA-N
Literature Reference Author R.P.SINGH,R.L.KIRCHMEIER,J.M.SHREEVE
Literature Reference Citation ORG.LETTERS,1,1047(1999)
Literature Reference DOI 10.1021/ol990844r
Solvent CDCl3
Source File Reference UWSI26436