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1H-pyrrolo[2,3-f]quinoline-2,7,9-tricarboxylic acid, 2-ethyl 7,9-dimethyl ester
SpectraBase Compound ID IZbzBpS9yx2
InChI InChI=1S/C18H16N2O6/c1-4-26-18(23)12-7-9-5-6-11-14(15(9)20-12)10(16(21)24-2)8-13(19-11)17(22)25-3/h5-8,20H,4H2,1-3H3
InChIKey XYFYONWYSJUOOS-UHFFFAOYSA-N
Mol Weight 356.33 g/mol
Molecular Formula C18H16N2O6
Exact Mass 356.100836 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B0MgfXO3vRA
Name 1H-pyrrolo[2,3-f]quinoline-2,7,9-tricarboxylic acid, 2-ethyl 7,9-dimethyl ester
CAS Registry Number 80721-40-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16N2O6
InChI InChI=1S/C18H16N2O6/c1-4-26-18(23)12-7-9-5-6-11-14(15(9)20-12)10(16(21)24-2)8-13(19-11)17(22)25-3/h5-8,20H,4H2,1-3H3
InChIKey XYFYONWYSJUOOS-UHFFFAOYSA-N
Molecular Weight 356.334 g/mol
SMILES [nH]1c(cc2ccc3nc(cc(c3c12)C(=O)OC)C(=O)OC)C(=O)OCC
SPLASH splash10-0pba-0098000000-faba22b7add72dec166d
Source of Spectrum J-50-1693-10
Synonyms 2-Ethyl 7,9-dimethyl 1H-pyrrolo[2,3-f]quinoline-2,7,9-tricarboxylate
Wiley ID 1345655