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4-(3-Ethoxy-3-keto-propyl)-1H-pyrrole-2,3,5-tricarboxylic acid triethyl ester
SpectraBase Compound ID 8qA4HwPDBzt
InChI InChI=1S/C18H25NO8/c1-5-24-12(20)10-9-11-13(16(21)25-6-2)15(18(23)27-8-4)19-14(11)17(22)26-7-3/h19H,5-10H2,1-4H3
InChIKey DGKTXIWKLXNMFC-UHFFFAOYSA-N
Mol Weight 383.4 g/mol
Molecular Formula C18H25NO8
Exact Mass 383.158017 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3pq4WMwGSBm
Name 4-(3-Ethoxy-3-keto-propyl)-1H-pyrrole-2,3,5-tricarboxylic acid triethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H25NO8
InChI InChI=1S/C18H25NO8/c1-5-24-12(20)10-9-11-13(16(21)25-6-2)15(18(23)27-8-4)19-14(11)17(22)26-7-3/h19H,5-10H2,1-4H3
InChIKey DGKTXIWKLXNMFC-UHFFFAOYSA-N
Molecular Weight 383.397 g/mol
SMILES [nH]1c(c(c(c1C(=O)OCC)C(=O)OCC)CCC(=O)OCC)C(=O)OCC
SPLASH splash10-0a4r-0019000000-408b93eb4019bd0d720a
Source of Spectrum HC-12-658-0
Synonyms 4-(3-Ethoxy-3-oxopropyl)-1H-pyrrole-2,3,5-tricarboxylic acid triethyl ester Triethyl 4-(3-ethoxy-3-oxidanylidene-propyl)-1H-pyrrole-2,3,5-tricarboxylate Triethyl 4-(3-ethoxy-3-oxo-propyl)-1H-pyrrole-2,3,5-tricarboxylate
Wiley ID 1361012