exo-3-Phenyl-2-(4-toluylsulfonyl)-2-azabicyclo[2.2.2]oxtan-5-one

SpectraBase Compound ID	3HayCGqytyQ
InChI	InChI=1S/C20H21NO3S/c1-14-7-10-17(11-8-14)25(23,24)21-16-9-12-18(19(22)13-16)20(21)15-5-3-2-4-6-15/h2-8,10-11,16,18,20H,9,12-13H2,1H3/t16-,18+,20-/m0/s1
InChIKey	LADGFPQVFWUDJJ-UHFFFAOYSA-N Google Search
Mol Weight	355.45 g/mol
Molecular Formula	C20H21NO3S
Exact Mass	355.124215 g/mol

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SpectraBase Spectrum ID	IBlccgSX5O
Name	exo-3-Phenyl-2-(4-toluylsulfonyl)-2-azabicyclo[2.2.2]oxtan-5-one
Comments	Less than 3 mono-isotopic peaks
Copyright	Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C20H21NO3S
InChI	InChI=1S/C20H21NO3S/c1-14-7-10-17(11-8-14)25(23,24)21-16-9-12-18(19(22)13-16)20(21)15-5-3-2-4-6-15/h2-8,10-11,16,18,20H,9,12-13H2,1H3/t16-,18+,20-/m0/s1
InChIKey	LADGFPQVFWUDJJ-UHFFFAOYSA-N
Molecular Weight	355.452 g/mol
SMILES	[C@@]1(N(S(c2ccc(cc2)C)(=O)=O)[C@]2(CC[C@@]1(C(C2)=O)[H])[H])(c1ccccc1)[H]
SPLASH	splash10-0udi-0092000000-6f8849fd93d1b3f95555
Source of Spectrum	U1-2002-3675-5
Synonyms	endo-3-Phenyl-2-(4-toluylsulfonyl)-2-azabicyclo[2.2.2]oxtan-5-one
Wiley ID	1523417