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Methyl 4-(3-(2-(4-acetamidophenoxy)acetyl)-2,5-dimethyl-1H-pyrrol-1-yl)benzoate

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Methyl 4-(3-(2-(4-acetamidophenoxy)acetyl)-2,5-dimethyl-1H-pyrrol-1-yl)benzoate
SpectraBase Compound ID JjZ7dw6vzM3
InChI InChI=1S/C24H24N2O5/c1-15-13-22(16(2)26(15)20-9-5-18(6-10-20)24(29)30-4)23(28)14-31-21-11-7-19(8-12-21)25-17(3)27/h5-13H,14H2,1-4H3,(H,25,27)
InChIKey BQZANZFRNAZTLQ-UHFFFAOYSA-N
Mol Weight 420.47 g/mol
Molecular Formula C24H24N2O5
Exact Mass 420.168522 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JnkA2vSXigI
Name Methyl 4-(3-(2-(4-acetamidophenoxy)acetyl)-2,5-dimethyl-1H-pyrrol-1-yl)benzoate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 420.168521876 u
Formula C24H24N2O5
InChI InChI=1S/C24H24N2O5/c1-15-13-22(16(2)26(15)20-9-5-18(6-10-20)24(29)30-4)23(28)14-31-21-11-7-19(8-12-21)25-17(3)27/h5-13H,14H2,1-4H3,(H,25,27)
InChIKey BQZANZFRNAZTLQ-UHFFFAOYSA-N
Molecular Weight 420.465 g/mol
SMILES C(C1=CC=C(C=C1)N1C(=C(C=C1C)C(=O)COC1=CC=C(C=C1)NC(C)=O)C)(=O)OC