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1-((4-Nitrophenyl)sulfonyl)-2-(3-((2R*,3S*)-3-(1-(triethylsiloxy)vinyl)oxiran-2-yl)propyl)-1H-pyrrole
SpectraBase Compound ID EBJCC1STn9X
InChI InChI=1S/C23H32N2O6SSi/c1-5-33(6-2,7-3)31-18(4)23-22(30-23)12-8-10-19-11-9-17-24(19)32(28,29)21-15-13-20(14-16-21)25(26)27/h9,11,13-17,22-23H,4-8,10,12H2,1-3H3/t22-,23-/m1/s1
InChIKey SBFSLKPVNHTHPM-DHIUTWEWSA-N
Mol Weight 492.7 g/mol
Molecular Formula C23H32N2O6SSi
Exact Mass 492.175034 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FcC3mZKZc14
Name 1-((4-Nitrophenyl)sulfonyl)-2-(3-((2R*,3S*)-3-(1-(triethylsiloxy)vinyl)oxiran-2-yl)propyl)-1H-pyrrole
Appearance Pale yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 492.175034461 u
Formula C23H32N2O6SSi
InChI InChI=1S/C23H32N2O6SSi/c1-5-33(6-2,7-3)31-18(4)23-22(30-23)12-8-10-19-11-9-17-24(19)32(28,29)21-15-13-20(14-16-21)25(26)27/h9,11,13-17,22-23H,4-8,10,12H2,1-3H3/t22-,23-/m1/s1
InChIKey SBFSLKPVNHTHPM-DHIUTWEWSA-N
Instrument Name Finnigan MAT 95 or API QSTAR PULSAR iLC/MS/TOF
Ionization Type EI
Literature Reference DOI 10.1002/anie.201711439
Molecular Weight 492.662 g/mol
Quality 130
Reported Formula C21H27N2O6SSi
SMILES C([C@@]1([C@](O1)(CCCC1=CC=CN1S(C1=CC=C(C=C1)[N+]([O-])=O)(=O)=O)[H])[H])(O[Si](CC)(CC)CC)=C
SPLASH splash10-0kka-5931000000-2f6942d77381e1e8c82b
Source of Spectrum ACI-57-SM28-2e (DOI: 10.1002/anie.201711439)
Thin-Layer Chromatography 0.51 (EtOAc/hexane, 10%)
Wiley ID 1890677