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4-ACETYL-2-CARBETHOXY-5-METHYLPYRROL-3-PROPIONSAEUREETHYLESTER
SpectraBase Compound ID 4zTec8fQ0i7
InChI InChI=1S/C15H21NO5/c1-5-20-12(18)8-7-11-13(10(4)17)9(3)16-14(11)15(19)21-6-2/h16H,5-8H2,1-4H3
InChIKey WSEZMEPHVSQQLB-UHFFFAOYSA-N
Mol Weight 295.33 g/mol
Molecular Formula C15H21NO5
Exact Mass 295.141973 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5cj02nudd3x
Name 1H-Pyrrole-3-propanoic acid, 4-acetyl-2-ethoxycarbonyl-5-methyl-, ethyl ester
Alternate Name(s) 4-Acetyl-3-(3-ethoxy-3-keto-propyl)-5-methyl-1H-pyrrole-2-carboxylic acid ethyl ester 4-Acetyl-3-(3-ethoxy-3-oxopropyl)-5-methyl-1H-pyrrole-2-carboxylic acid ethyl ester Ethyl 4-acetyl-3-(3-ethoxy-3-oxo-propyl)-5-methyl-1H-pyrrole-2-carboxylate Ethyl 4-ethanoyl-3-(3-ethoxy-3-oxidanylidene-propyl)-5-methyl-1H-pyrrole-2-carboxylate
CAS Registry Number 40515-73-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H21NO5
InChI InChI=1S/C15H21NO5/c1-5-20-12(18)8-7-11-13(10(4)17)9(3)16-14(11)15(19)21-6-2/h16H,5-8H2,1-4H3
InChIKey WSEZMEPHVSQQLB-UHFFFAOYSA-N
Molecular Weight 295.335 g/mol
SMILES [nH]1c(c(c(c1C(=O)OCC)CCC(=O)OCC)C(=O)C)C
SPLASH splash10-0a6r-2970000000-a4a39573a5dc632469dd
Wiley ID 1478937