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(E,6R)-6-(benzenesulfonyloxy)-7-(4-fluorophenoxy)-2-heptenoic acid ethyl ester
SpectraBase Compound ID LZef6OhtxDO
InChI InChI=1S/C21H23FO6S/c1-2-26-21(23)11-7-6-8-19(16-27-18-14-12-17(22)13-15-18)28-29(24,25)20-9-4-3-5-10-20/h3-5,7,9-15,19H,2,6,8,16H2,1H3/b11-7+/t19-/m1/s1
InChIKey LRALAANLLYKPPS-BQHJZSHBSA-N
Mol Weight 422.47 g/mol
Molecular Formula C21H23FO6S
Exact Mass 422.119938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 27A1HI8B6ZR
Name (E,6R)-6-(benzenesulfonyloxy)-7-(4-fluorophenoxy)-2-heptenoic acid ethyl ester
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23FO6S
InChI InChI=1S/C21H23FO6S/c1-2-26-21(23)11-7-6-8-19(16-27-18-14-12-17(22)13-15-18)28-29(24,25)20-9-4-3-5-10-20/h3-5,7,9-15,19H,2,6,8,16H2,1H3/b11-7+/t19-/m1/s1
InChIKey LRALAANLLYKPPS-BQHJZSHBSA-N
Molecular Weight 422.467 g/mol
SMILES C(\C=C\CC[C@](COc1ccc(cc1)F)(OS(=O)(=O)c1ccccc1)[H])(=O)OCC
SPLASH splash10-004l-9300000000-580f6f2759a796de2345
Source of Spectrum KD-14-1368-14
Synonyms (E,6R)-6-besyloxy-7-(4-fluorophenoxy)hept-2-enoic acid ethyl ester Ethyl (E,6R)-6-(benzenesulfonyloxy)-7-(4-fluorophenoxy)hept-2-enoate Ethyl (E,6R)-7-(4-fluoranylphenoxy)-6-(phenylsulfonyloxy)hept-2-enoate
Wiley ID 1636082