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Ethyl 4-acetyl-1-[(2-phenylacetyl)amino]-2,5-dimethyl-1H-pyroole-3-carboxylate
SpectraBase Compound ID I76uLCMZPK1
InChI InChI=1S/C19H22N2O4/c1-5-25-19(24)18-13(3)21(12(2)17(18)14(4)22)20-16(23)11-15-9-7-6-8-10-15/h6-10H,5,11H2,1-4H3,(H,20,23)
InChIKey KRVBWEYSPMSKMB-UHFFFAOYSA-N
Mol Weight 342.4 g/mol
Molecular Formula C19H22N2O4
Exact Mass 342.157957 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 45eUOkY6ADP
Name Ethyl 4-acetyl-1-[(2-phenylacetyl)amino]-2,5-dimethyl-1H-pyroole-3-carboxylate
Alternate Name(s) 4-acetyl-2,5-dimethyl-1-[(1-oxo-2-phenylethyl)amino]-3-pyrrolecarboxylic acid ethyl ester ethyl 4-acetyl-2,5-dimethyl-1-[(2-phenylacetyl)amino]pyrrole-3-carboxylate ethyl 4-ethanoyl-2,5-dimethyl-1-(2-phenylethanoylamino)pyrrole-3-carboxylate
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H22N2O4
InChI InChI=1S/C19H22N2O4/c1-5-25-19(24)18-13(3)21(12(2)17(18)14(4)22)20-16(23)11-15-9-7-6-8-10-15/h6-10H,5,11H2,1-4H3,(H,20,23)
InChIKey KRVBWEYSPMSKMB-UHFFFAOYSA-N
Molecular Weight 342.395 g/mol
SMILES N([n]1c(c(c(c1C)C(=O)C)C(=O)OCC)C)C(=O)Cc1ccccc1
SPLASH splash10-0002-0094000000-44ee38eba71c7e8b3d62
Source of Spectrum KC-57-1391-5
Wiley ID 1622890