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2-(1-besylpyrrol-2-yl)-1,4-naphthoquinone
SpectraBase Compound ID 12cF3JXFTGV
InChI InChI=1S/C20H13NO4S/c22-19-13-17(20(23)16-10-5-4-9-15(16)19)18-11-6-12-21(18)26(24,25)14-7-2-1-3-8-14/h1-13H
InChIKey MQVFZNOZYDXUNO-UHFFFAOYSA-N
Mol Weight 363.39 g/mol
Molecular Formula C20H13NO4S
Exact Mass 363.056529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4CdMWNRnDSx
Name 2-(1-besylpyrrol-2-yl)-1,4-naphthoquinone
CAS Registry Number 99113-65-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H13NO4S
InChI InChI=1S/C20H13NO4S/c22-19-13-17(20(23)16-10-5-4-9-15(16)19)18-11-6-12-21(18)26(24,25)14-7-2-1-3-8-14/h1-13H
InChIKey MQVFZNOZYDXUNO-UHFFFAOYSA-N
Molecular Weight 363.387 g/mol
SMILES c1([n](S(=O)(=O)c2ccccc2)ccc1)C=1C(c2ccccc2C(C1)=O)=O
SPLASH splash10-03di-0339000000-54dc4a3d312e05aee040
Source of Spectrum J-50-5549-13
Synonyms 2-[1-(benzenesulfonyl)-2-pyrrolyl]naphthalene-1,4-dione 2-[1-(benzenesulfonyl)pyrrol-2-yl]naphthalene-1,4-dione 2-[1-(phenylsulfonyl)pyrrol-2-yl]naphthalene-1,4-dione
Wiley ID 1350231