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2-(4-mesylbutyl)isoindoline-1,3-quinone
SpectraBase Compound ID D2Lssqrvwl5
InChI InChI=1S/C13H15NO4S/c1-19(17,18)9-5-4-8-14-12(15)10-6-2-3-7-11(10)13(14)16/h2-3,6-7H,4-5,8-9H2,1H3
InChIKey ACMARYKASKPJRN-UHFFFAOYSA-N
Mol Weight 281.33 g/mol
Molecular Formula C13H15NO4S
Exact Mass 281.072179 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DhMLdmg3NrP
Name 2-(4-mesylbutyl)isoindoline-1,3-quinone
Alternate Name(s) 2-(4-Methylsulfonylbutyl)isoindole-1,3-dione 2-(4-Methylsulfonylbutyl)isoindoline-1,3-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15NO4S
InChI InChI=1S/C13H15NO4S/c1-19(17,18)9-5-4-8-14-12(15)10-6-2-3-7-11(10)13(14)16/h2-3,6-7H,4-5,8-9H2,1H3
InChIKey ACMARYKASKPJRN-UHFFFAOYSA-N
Molecular Weight 281.326 g/mol
SMILES C1(N(C(c2ccccc12)=O)CCCCS(=O)(=O)C)=O
SPLASH splash10-03di-0910000000-ea71f94ae40841c50f25
Source of Spectrum QC-6-1573-6
Wiley ID 868862