(3S,3aS,6S,6aS)-3-(hydroxymethyl)-6-methyl-2-(4-methylphenyl)sulfonyl-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrol-5-one

SpectraBase Compound ID	1wW3tTp1q70
InChI	InChI=1S/C16H21NO4S/c1-10-3-5-12(6-4-10)22(20,21)17-8-14-11(2)16(19)7-13(14)15(17)9-18/h3-6,11,13-15,18H,7-9H2,1-2H3/t11-,13-,14+,15+/m0/s1
InChIKey	FHVPGYXPZAYEJS-SPWCGHHHSA-N Google Search
Mol Weight	323.41 g/mol
Molecular Formula	C16H21NO4S
Exact Mass	323.119129 g/mol

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SpectraBase Spectrum ID	EQq1Q4icozw
Name	(3S,3aS,6S,6aS)-3-(hydroxymethyl)-6-methyl-2-(4-methylphenyl)sulfonyl-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrol-5-one
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C16H21NO4S
InChI	InChI=1S/C16H21NO4S/c1-10-3-5-12(6-4-10)22(20,21)17-8-14-11(2)16(19)7-13(14)15(17)9-18/h3-6,11,13-15,18H,7-9H2,1-2H3/t11-,13-,14+,15+/m0/s1
InChIKey	FHVPGYXPZAYEJS-SPWCGHHHSA-N
Molecular Weight	323.407 g/mol
SMILES	OC[C@@]1([C@]2(CC([C@]([C@]2(CN1S(c1ccc(cc1)C)(=O)=O)[H])(C)[H])=O)[H])[H]
SPLASH	splash10-0006-3490000000-cba06290b83c8baba884
Source of Spectrum	J-59-6971-17
Synonyms	(3S,3aS,6S,6aS)-3-(hydroxymethyl)-6-methyl-2-(p-tolylsulfonyl)-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrol-5-one (3S,3aS,6S,6aS)-6-methyl-3-methylol-2-tosyl-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrol-5-one
Wiley ID	1322361