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Ethyl 4-(5-methoxycarbonyl-1-oxo-4-pentenyl)-1H-pyrrole-2-carboxylate
SpectraBase Compound ID A983nssiLue
InChI InChI=1S/C14H17NO5/c1-3-20-14(18)11-8-10(9-15-11)12(16)6-4-5-7-13(17)19-2/h5,7-9,15H,3-4,6H2,1-2H3/b7-5+
InChIKey XYTDDKUQXGKFIY-FNORWQNLSA-N
Mol Weight 279.29 g/mol
Molecular Formula C14H17NO5
Exact Mass 279.110673 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID nXAYZogiFA
Name Ethyl 4-(5-methoxycarbonyl-1-oxo-4-pentenyl)-1H-pyrrole-2-carboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C14H17NO5
InChI InChI=1S/C14H17NO5/c1-3-20-14(18)11-8-10(9-15-11)12(16)6-4-5-7-13(17)19-2/h5,7-9,15H,3-4,6H2,1-2H3/b7-5+
InChIKey XYTDDKUQXGKFIY-FNORWQNLSA-N
Molecular Weight 279.292 g/mol
SMILES [nH]1cc(cc1C(=O)OCC)C(CC\C=C\C(=O)OC)=O
SPLASH splash10-00di-0910000000-c3a873ca5cfdedd4a268
Source of Spectrum E1-39-2835-9
Synonyms ethyl 4-[(4E)-6-methoxy-6-oxo-4-hexenoyl]-1H-pyrrole-2-carboxylate
Wiley ID 1519170