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trifluoromethanesulfonic acid [(5Z)-5-[4-(2-ethynylphenyl)-4-hydroxy-but-2-ynylidene]-1-cyclopentenyl] ester
SpectraBase Compound ID AI3wean1OLU
InChI InChI=1S/C18H13F3O4S/c1-2-13-7-3-4-10-15(13)16(22)11-5-8-14-9-6-12-17(14)25-26(23,24)18(19,20)21/h1,3-4,7-8,10,12,16,22H,6,9H2/b14-8-
InChIKey SATTYKCGBVVDRY-ZSOIEALJSA-N
Mol Weight 382.35 g/mol
Molecular Formula C18H13F3O4S
Exact Mass 382.048665 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KXJDgAdx0ih
Name trifluoromethanesulfonic acid [(5Z)-5-[4-(2-ethynylphenyl)-4-hydroxy-but-2-ynylidene]-1-cyclopentenyl] ester
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H13F3O4S
InChI InChI=1S/C18H13F3O4S/c1-2-13-7-3-4-10-15(13)16(22)11-5-8-14-9-6-12-17(14)25-26(23,24)18(19,20)21/h1,3-4,7-8,10,12,16,22H,6,9H2/b14-8-
InChIKey SATTYKCGBVVDRY-ZSOIEALJSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2006)
Molecular Weight 382.354 g/mol
Source File Reference MHKO1135