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Pyrrolidine, 1-[2-(methylsulfonyl)-7-thiabicyclo[4.2.0]oct-1-yl]-, S,S-dioxide
SpectraBase Compound ID EgV8UzUFkfQ
InChI InChI=1S/C12H21NO4S2/c1-18(14,15)10-5-4-6-11-12(10,9-19(11,16)17)13-7-2-3-8-13/h10-11H,2-9H2,1H3
InChIKey XDIVZFSAPIPZMV-UHFFFAOYSA-N
Mol Weight 307.42 g/mol
Molecular Formula C12H21NO4S2
Exact Mass 307.091201 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1McvvGboM2Y
Name Pyrrolidine, 1-[2-(methylsulfonyl)-7-thiabicyclo[4.2.0]oct-1-yl]-, S,S-dioxide
CAS Registry Number 56595-85-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H21NO4S2
InChI InChI=1S/C12H21NO4S2/c1-18(14,15)10-5-4-6-11-12(10,9-19(11,16)17)13-7-2-3-8-13/h10-11H,2-9H2,1H3
InChIKey XDIVZFSAPIPZMV-UHFFFAOYSA-N
Molecular Weight 307.423 g/mol
SMILES C12(CS(C2CCCC1S(=O)(=O)C)(=O)=O)N1CCCC1
SPLASH splash10-0ika-1910000000-de3bee71623a0b3939bf
Source of Spectrum SB-29-335-0
Synonyms 1-[2-(methylsulfonyl)-7,7-dioxido-7-thiabicyclo[4.2.0]oct-1-yl]pyrrolidine 2-Methylsulfonyl-1-(n-pyrrolidino)-7-thiabicyclo(4.2.0)octane-7,7-dioxide 7,7-Dioxido-1-(1-pyrrolidinyl)-7-thiabicyclo[4.2.0]oct-2-yl methyl sulfone 7-Thiabicyclo[4.2.0]octane, pyrrolidine deriv.
Wiley ID 1308788