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[(5R)-3-(3-fluoranyl-4-thiomorpholin-4-yl-phenyl)-2-oxidanylidene-1,3-oxazolidin-5-yl]methyl 4-methylbenzenesulfonate
SpectraBase Compound ID G8n27KNbTbz
InChI InChI=1S/C21H23FN2O5S2/c1-15-2-5-18(6-3-15)31(26,27)28-14-17-13-24(21(25)29-17)16-4-7-20(19(22)12-16)23-8-10-30-11-9-23/h2-7,12,17H,8-11,13-14H2,1H3/t17-/m1/s1
InChIKey JLDPJKVAJJNZGJ-QGZVFWFLSA-N
Mol Weight 466.54 g/mol
Molecular Formula C21H23FN2O5S2
Exact Mass 466.103242 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 784AYa00Bkn
Name [(5R)-3-(3-fluoranyl-4-thiomorpholin-4-yl-phenyl)-2-oxidanylidene-1,3-oxazolidin-5-yl]methyl 4-methylbenzenesulfonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23FN2O5S2
InChI InChI=1S/C21H23FN2O5S2/c1-15-2-5-18(6-3-15)31(26,27)28-14-17-13-24(21(25)29-17)16-4-7-20(19(22)12-16)23-8-10-30-11-9-23/h2-7,12,17H,8-11,13-14H2,1H3/t17-/m1/s1
InChIKey JLDPJKVAJJNZGJ-QGZVFWFLSA-N
Molecular Weight 466.542 g/mol
SMILES c1(ccc(cc1)C)S(=O)(=O)OC[C@@]1(OC(N(C1)c1cc(c(cc1)N1CCSCC1)F)=O)[H]
SPLASH splash10-014l-2302900000-b807f76beb3934564476
Source of Spectrum E1-39-683-0
Synonyms [(5R)-3-(3-fluoro-4-thiomorpholin-4-ylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl 4-methylbenzenesulfonate [(5R)-3-(3-fluoro-4-thiomorpholino-phenyl)-2-oxo-oxazolidin-5-yl]methyl 4-methylbenzenesulfonate 4-Methylbenzenesulfonic acid [(5R)-3-(3-fluoro-4-thiomorpholin-4-ylphenyl)-2-oxo-5-oxazolidinyl]methyl ester
Wiley ID 1598744