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2-Formyl-1-phenylsulfonylpyrrolo-3-ylacetic acid
SpectraBase Compound ID D1ILJa4HsNj
InChI InChI=1S/C13H11NO5S/c15-9-12-10(8-13(16)17)6-7-14(12)20(18,19)11-4-2-1-3-5-11/h1-7,9H,8H2,(H,16,17)
InChIKey YWZCPBBJTGRETI-UHFFFAOYSA-N
Mol Weight 293.29 g/mol
Molecular Formula C13H11NO5S
Exact Mass 293.035794 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6zMftAbVseL
Name 2-Formyl-1-phenylsulfonylpyrrolo-3-ylacetic acid
Alternate Name(s) [2-formyl-1-(phenylsulfonyl)-1H-pyrrol-3-yl]acetic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H11NO5S
InChI InChI=1S/C13H11NO5S/c15-9-12-10(8-13(16)17)6-7-14(12)20(18,19)11-4-2-1-3-5-11/h1-7,9H,8H2,(H,16,17)
InChIKey YWZCPBBJTGRETI-UHFFFAOYSA-N
Molecular Weight 293.293 g/mol
SMILES OC(Cc1c([n](S(=O)(=O)c2ccccc2)cc1)C=O)=O
SPLASH splash10-056r-9910000000-a97b2d674575e68e49e8
Source of Spectrum F-48-7455-0
Wiley ID 1296173