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Methyl 5-(formyl-3',4'-dimethyl-1H-pyrrol-2'-yl)methylidene]-2,5-dihydro-4-methyl-2-oxo-1H-pyrrole-3-propanoate
SpectraBase Compound ID 6YJxYSwWv3c
InChI InChI=1S/C17H20N2O4/c1-9-10(2)15(8-20)18-13(9)7-14-11(3)12(17(22)19-14)5-6-16(21)23-4/h7-8,18H,5-6H2,1-4H3,(H,19,22)/b14-7+
InChIKey KMKLHEPKLXSIRH-VGOFMYFVSA-N
Mol Weight 316.36 g/mol
Molecular Formula C17H20N2O4
Exact Mass 316.142307 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AAYG2EX43JP
Name Methyl 5-(formyl-3',4'-dimethyl-1H-pyrrol-2'-yl)methylidene]-2,5-dihydro-4-methyl-2-oxo-1H-pyrrole-3-propanoate
Comments Less than 3 mono-isotopic peaks
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Formula C17H20N2O4
InChI InChI=1S/C17H20N2O4/c1-9-10(2)15(8-20)18-13(9)7-14-11(3)12(17(22)19-14)5-6-16(21)23-4/h7-8,18H,5-6H2,1-4H3,(H,19,22)/b14-7+
InChIKey KMKLHEPKLXSIRH-VGOFMYFVSA-N
Molecular Weight 316.357 g/mol
SMILES N1\C(=C\c2[nH]c(c(c2C)C)C=O)C(=C(CCC(=O)OC)C1=O)C
SPLASH splash10-066r-0059000000-6f04c7bbc645b83173a4
Source of Spectrum H-77-1846-4
Synonyms methyl 3-{(5E)-5-[(5-formyl-3,4-dimethyl-1H-pyrrol-2-yl)methylene]-4-methyl-2-oxo-2,5-dihydro-1H-pyrrol-3-yl}propanoate
Wiley ID 1316708