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3-(1H-pyrrol-1-yl)-1-benzofuran-2-carboxylic acid
SpectraBase Compound ID 5NgtPPf7NuV
InChI InChI=1S/C13H9NO3/c15-13(16)12-11(14-7-3-4-8-14)9-5-1-2-6-10(9)17-12/h1-8H,(H,15,16)
InChIKey YCTXQBNFNACZHO-UHFFFAOYSA-N
Mol Weight 227.22 g/mol
Molecular Formula C13H9NO3
Exact Mass 227.058243 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F9yhkRjDj7M
Name 3-(1H-Pyrrol-1-yl)-1-benzofuran-2-carboxylic acid
Alternate Name(s) 3-(1-pyrrolyl)-2-benzofurancarboxylic acid 3-Pyrrol-1-yl-1-benzofuran-2-carboxylic acid 3-Pyrrol-1-ylbenzofuran-2-carboxylic acid 3-Pyrrol-1-ylcoumarilic acid Benzofurane-2-carboxylic acid, 3-(1H-pyrrolidin-1-yl)-
CAS Registry Number 80066-99-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H9NO3
InChI InChI=1S/C13H9NO3/c15-13(16)12-11(14-7-3-4-8-14)9-5-1-2-6-10(9)17-12/h1-8H,(H,15,16)
InChIKey YCTXQBNFNACZHO-UHFFFAOYSA-N
Molecular Weight 227.219 g/mol
SMILES OC(c1c(c2ccccc2o1)-[n]1cccc1)=O
SPLASH splash10-004i-3950000000-b6275da3b418d0abf93e
Source of Spectrum AD-0-2532-0
Wiley ID 1434117