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(3R,4R)-3-(2-bromanylpropan-2-yl)-1-methyl-4-(phenylsulfonylmethyl)pyrrolidin-2-one
SpectraBase Compound ID 4dDBTSSheHg
InChI InChI=1S/C15H20BrNO3S/c1-15(2,16)13-11(9-17(3)14(13)18)10-21(19,20)12-7-5-4-6-8-12/h4-8,11,13H,9-10H2,1-3H3/t11-,13-/m1/s1
InChIKey URQGUJLGSVLZBB-DGCLKSJQSA-N
Mol Weight 374.29 g/mol
Molecular Formula C15H20BrNO3S
Exact Mass 373.034728 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8hqSBIh7SLr
Name (3R,4R)-3-(2-bromanylpropan-2-yl)-1-methyl-4-(phenylsulfonylmethyl)pyrrolidin-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20BrNO3S
InChI InChI=1S/C15H20BrNO3S/c1-15(2,16)13-11(9-17(3)14(13)18)10-21(19,20)12-7-5-4-6-8-12/h4-8,11,13H,9-10H2,1-3H3/t11-,13-/m1/s1
InChIKey URQGUJLGSVLZBB-DGCLKSJQSA-N
Molecular Weight 374.293 g/mol
SMILES C(S(=O)(=O)c1ccccc1)[C@@]1([C@](C(=O)N(C1)C)(C(Br)(C)C)[H])[H]
SPLASH splash10-0019-5940000000-573b07ff7150e7c06402
Source of Spectrum J-64-2351-13
Synonyms (3R,4R)-4-(benzenesulfonylmethyl)-3-(1-bromo-1-methyl-ethyl)-1-methyl-pyrrolidin-2-one (3R,4R)-4-(benzenesulfonylmethyl)-3-(2-bromopropan-2-yl)-1-methyl-2-pyrrolidinone (3R,4R)-4-(benzenesulfonylmethyl)-3-(2-bromopropan-2-yl)-1-methylpyrrolidin-2-one (3R,4R)-4-(besylmethyl)-3-(1-bromo-1-methyl-ethyl)-1-methyl-2-pyrrolidone
Wiley ID 1529788