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3-[4'-hydroxy-1'-(p-tolylsulphonyl)-2'-trimethylsilylbutan-2'-yl]-5-methoxy-1-(4-methoxybenzyl)-3,6-dihydropyrazin-2(1H)-one
SpectraBase Compound ID JIGdwB7ZzJR
InChI InChI=1S/C27H38N2O6SSi/c1-20-7-13-23(14-8-20)36(32,33)19-27(15-16-30,37(4,5)6)25-26(31)29(18-24(28-25)35-3)17-21-9-11-22(34-2)12-10-21/h7-14,25,30H,15-19H2,1-6H3
InChIKey OZWKSBVNCGDXQE-UHFFFAOYSA-N
Mol Weight 546.8 g/mol
Molecular Formula C27H38N2O6SSi
Exact Mass 546.221985 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GHsWfrkd9oI
Name 3-[4'-hydroxy-1'-(p-tolylsulphonyl)-2'-trimethylsilylbutan-2'-yl]-5-methoxy-1-(4-methoxybenzyl)-3,6-dihydropyrazin-2(1H)-one
CAS Registry Number 104124-11-0
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H38N2O6SSi
InChI InChI=1S/C27H38N2O6SSi/c1-20-7-13-23(14-8-20)36(32,33)19-27(15-16-30,37(4,5)6)25-26(31)29(18-24(28-25)35-3)17-21-9-11-22(34-2)12-10-21/h7-14,25,30H,15-19H2,1-6H3
InChIKey OZWKSBVNCGDXQE-UHFFFAOYSA-N
Molecular Weight 546.754 g/mol
SMILES OCCC(C1C(N(Cc2ccc(cc2)OC)CC(=N1)OC)=O)(CS(c1ccc(cc1)C)(=O)=O)[Si](C)(C)C
SPLASH splash10-00di-0900000000-eb0be12ca11cd2744ee4
Source of Spectrum KC-1988-2592-30
Synonyms 3-[3-hydroxy-1-{[(4-methylphenyl)sulfonyl]methyl}-1-(trimethylsilyl)propyl]-5-methoxy-1-(4-methoxybenzyl)-3,6-dihydro-2(1H)-pyrazinone
Wiley ID 1405229