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1H-Pyrrole-3-acetic acid, 2,5-dihydro-4-methyl-1-(4-methylphenyl)-2,5-dioxo-, ethyl ester
SpectraBase Compound ID 8NgJPziNqst
InChI InChI=1S/C16H17NO4/c1-4-21-14(18)9-13-11(3)15(19)17(16(13)20)12-7-5-10(2)6-8-12/h5-8H,4,9H2,1-3H3
InChIKey DUVVEQVVACATLH-UHFFFAOYSA-N
Mol Weight 287.31 g/mol
Molecular Formula C16H17NO4
Exact Mass 287.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6nsITzMX7mG
Name 1H-Pyrrole-3-acetic acid, 2,5-dihydro-4-methyl-1-(4-methylphenyl)-2,5-dioxo-, ethyl ester
CAS Registry Number 110853-96-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17NO4
InChI InChI=1S/C16H17NO4/c1-4-21-14(18)9-13-11(3)15(19)17(16(13)20)12-7-5-10(2)6-8-12/h5-8H,4,9H2,1-3H3
InChIKey DUVVEQVVACATLH-UHFFFAOYSA-N
Molecular Weight 287.315 g/mol
SMILES C1(N(C(C(=C1CC(=O)OCC)C)=O)c1ccc(cc1)C)=O
SPLASH splash10-0udi-0190000000-e87b689b5726f06997c8
Source of Spectrum AJ-60-1495-41
Synonyms 1-(p-tolyl)-3-methyl-4-(ethoxycarbonylmethyl)pyrrol-2,5-dione Ethyl[4-methyl-1-(4-methylphenyl)-2,5-dioxo-2,5-dihydro-1H-pyrrol-3-yl]acetate
Wiley ID 1290816