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3,5-bis(ethoxycarbonyl)-4-phenyl-1H-pyrrole-2-carboxylic acid
SpectraBase Compound ID 54ZM6kM8TSc
InChI InChI=1S/C17H17NO6/c1-3-23-16(21)12-11(10-8-6-5-7-9-10)14(17(22)24-4-2)18-13(12)15(19)20/h5-9,18H,3-4H2,1-2H3,(H,19,20)
InChIKey UUXHQWHCDLTVJZ-UHFFFAOYSA-N
Mol Weight 331.32 g/mol
Molecular Formula C17H17NO6
Exact Mass 331.105587 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CWlzZLBMvWP
Name 3,5-bis(ethoxycarbonyl)-4-phenyl-1H-pyrrole-2-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17NO6
InChI InChI=1S/C17H17NO6/c1-3-23-16(21)12-11(10-8-6-5-7-9-10)14(17(22)24-4-2)18-13(12)15(19)20/h5-9,18H,3-4H2,1-2H3,(H,19,20)
InChIKey UUXHQWHCDLTVJZ-UHFFFAOYSA-N
Molecular Weight 331.324 g/mol
SMILES [nH]1c(c(c(c1C(=O)O)C(=O)OCC)-c1ccccc1)C(=O)OCC
SPLASH splash10-001i-0079000000-337a6403f0a011522f69
Source of Spectrum AT-36-3407-6
Synonyms 3,5-Dicarbethoxy-4-phenyl-1H-pyrrole-2-carboxylic acid
Wiley ID 853215