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4-(bromomethyl)-3,3-dimethyl-1-(4-methylphenyl)sulfonyl-pyrrolidin-2-one
SpectraBase Compound ID 2fHwHrJ0ls2
InChI InChI=1S/C14H18BrNO3S/c1-10-4-6-12(7-5-10)20(18,19)16-9-11(8-15)14(2,3)13(16)17/h4-7,11H,8-9H2,1-3H3
InChIKey MXHPLOFTIGKFJJ-UHFFFAOYSA-N
Mol Weight 360.27 g/mol
Molecular Formula C14H18BrNO3S
Exact Mass 359.019078 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8AVqeOWqh9M
Name 4-(bromomethyl)-3,3-dimethyl-1-(4-methylphenyl)sulfonyl-pyrrolidin-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18BrNO3S
InChI InChI=1S/C14H18BrNO3S/c1-10-4-6-12(7-5-10)20(18,19)16-9-11(8-15)14(2,3)13(16)17/h4-7,11H,8-9H2,1-3H3
InChIKey MXHPLOFTIGKFJJ-UHFFFAOYSA-N
Molecular Weight 360.266 g/mol
SMILES c1(S(N2C(C(C)(C)C(C2)CBr)=O)(=O)=O)ccc(cc1)C
SPLASH splash10-0002-3920000000-43270983cbe8e98a5a2f
Source of Spectrum J-64-8957-20
Synonyms 4-(bromomethyl)-3,3-dimethyl-1-(p-tolylsulfonyl)pyrrolidin-2-one 4-(bromomethyl)-3,3-dimethyl-1-tosyl-2-pyrrolidone 4-(bromomethyl)-3,3-dimethyl-1-(4-methylphenyl)sulfonyl-2-pyrrolidinone
Wiley ID 1531636