(3R,4R)-3-(2,2-Dimethylpropyl)-1-phenyl-4-[(phenylthio)methyl]-2-pyrrolidinone

SpectraBase Compound ID	4ohYCLmcYqh
InChI	InChI=1S/C22H27NOS/c1-22(2,3)14-20-17(16-25-19-12-8-5-9-13-19)15-23(21(20)24)18-10-6-4-7-11-18/h4-13,17,20H,14-16H2,1-3H3/t17-,20-/m1/s1
InChIKey	PWJBRRHSJKYEFV-YLJYHZDGSA-N Google Search
Mol Weight	353.52 g/mol
Molecular Formula	C22H27NOS
Exact Mass	353.181336 g/mol

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SpectraBase Spectrum ID	4XivrmXEbod
Name	(3R,4R)-3-(2,2-Dimethylpropyl)-1-phenyl-4-[(phenylthio)methyl]-2-pyrrolidinone
Alternate Name(s)	(trans)-3-(2',2'-Dimethylpropyl)-1-phenyl-4-[(phenylthio)methyl]-2-pyrrolidinone (3R,4R)-3-neopentyl-1-phenyl-4-[(phenylsulfanyl)methyl]-2-pyrrolidinone trans-3-(2,2-Dimethylpropyl)-1-phenyl-4-[(phenylthio)methyl]-2-pyrrolidinone
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C22H27NOS
InChI	InChI=1S/C22H27NOS/c1-22(2,3)14-20-17(16-25-19-12-8-5-9-13-19)15-23(21(20)24)18-10-6-4-7-11-18/h4-13,17,20H,14-16H2,1-3H3/t17-,20-/m1/s1
InChIKey	PWJBRRHSJKYEFV-YLJYHZDGSA-N
Molecular Weight	353.524 g/mol
SMILES	C1(N(C[C@@]([C@]1(CC(C)(C)C)[H])(CSc1ccccc1)[H])c1ccccc1)=O
SPLASH	splash10-0a4u-5796000000-c6d31f09e73e8ac1ccd2
Source of Spectrum	C-118-9838-8b/R
Wiley ID	1698841