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Trifluoromethanesulfonic acid 2-((E)-3-hydroxy-1-methyl-propenyl)-thiazol-4-yl ester
SpectraBase Compound ID LWHoYsPY5eJ
InChI InChI=1S/C8H8F3NO4S2/c1-5(2-3-13)7-12-6(4-17-7)16-18(14,15)8(9,10)11/h2,4,13H,3H2,1H3/b5-2+
InChIKey BEBMRWOPNFDRDU-GORDUTHDSA-N
Mol Weight 303.27 g/mol
Molecular Formula C8H8F3NO4S2
Exact Mass 302.984685 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4a5mrxubkpW
Name Trifluoromethanesulfonic acid 2-((E)-3-hydroxy-1-methyl-propenyl)-thiazol-4-yl ester
Alternate Name(s) (E)-2-(4-hydroxybut-2-en-2-yl)thiazol-4-yl trifluoromethanesulfonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H8F3NO4S2
InChI InChI=1S/C8H8F3NO4S2/c1-5(2-3-13)7-12-6(4-17-7)16-18(14,15)8(9,10)11/h2,4,13H,3H2,1H3/b5-2+
InChIKey BEBMRWOPNFDRDU-GORDUTHDSA-N
Literature Reference DOI 10.1021/ol900893e
Molecular Weight 303.270 g/mol
SMILES OC\C=C/(C)c1scc(OS(C(F)(F)F)(=O)=O)n1
SPLASH splash10-00di-6920000000-d06636447ed4753623df
Source of Spectrum A1-11-2756/SMS9-arb3
Wiley ID 1756866