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(E)-4-(perfluorophenyl)but-2-en-1-yl 4-methylbenzenesulfonate
SpectraBase Compound ID 7JY6HRpnIxR
InChI InChI=1S/C17H13F5O3S/c1-10-5-7-11(8-6-10)26(23,24)25-9-3-2-4-12-13(18)15(20)17(22)16(21)14(12)19/h2-3,5-8H,4,9H2,1H3/b3-2+
InChIKey SYQIMSBXKBLWEH-NSCUHMNNSA-N
Mol Weight 392.34 g/mol
Molecular Formula C17H13F5O3S
Exact Mass 392.050556 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EqoU1U5X1YW
Name (E)-4-(perfluorophenyl)but-2-en-1-yl 4-methylbenzenesulfonate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H13F5O3S
InChI InChI=1S/C17H13F5O3S/c1-10-5-7-11(8-6-10)26(23,24)25-9-3-2-4-12-13(18)15(20)17(22)16(21)14(12)19/h2-3,5-8H,4,9H2,1H3/b3-2+
InChIKey SYQIMSBXKBLWEH-NSCUHMNNSA-N
Literature Reference DOI 10.1021/ol501247b
Molecular Weight 392.340 g/mol
SMILES C(OS(c1ccc(cc1)C)(=O)=O)\C=C\Cc1c(c(c(F)c(c1F)F)F)F
SPLASH splash10-007c-0905000000-2bb148e546001b7449b0
Source of Spectrum A1-16-3118/SM7-3k
Wiley ID 1749577