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3-Acetyl-4-ethoxycarbonyl-5-methyl-1-(N'-phenylureido)-3-propargyl-1H-pyrrol-2(3H)-one
SpectraBase Compound ID 8As2tYEM7Uc
InChI InChI=1S/C20H21N3O5/c1-5-12-20(14(4)24)16(17(25)28-6-2)13(3)23(18(20)26)22-19(27)21-15-10-8-7-9-11-15/h1,7-11H,6,12H2,2-4H3,(H2,21,22,27)
InChIKey VFXVATCBLXZCHE-UHFFFAOYSA-N
Mol Weight 383.4 g/mol
Molecular Formula C20H21N3O5
Exact Mass 383.148121 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7zY6Qe51Qcs
Name 3-Acetyl-4-ethoxycarbonyl-5-methyl-1-(N'-phenylureido)-3-propargyl-1H-pyrrol-2(3H)-one
Alternate Name(s) Ethyl 4-acetyl-1-[(anilinocarbonyl)amino]-2-methyl-5-oxo-4-(2-propynyl)-4,5-dihydro-1H-pyrrole-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H21N3O5
InChI InChI=1S/C20H21N3O5/c1-5-12-20(14(4)24)16(17(25)28-6-2)13(3)23(18(20)26)22-19(27)21-15-10-8-7-9-11-15/h1,7-11H,6,12H2,2-4H3,(H2,21,22,27)
InChIKey VFXVATCBLXZCHE-UHFFFAOYSA-N
Molecular Weight 383.404 g/mol
SMILES N(N1C(=C(C(C1=O)(C(=O)C)CC#C)C(=O)OCC)C)C(Nc1ccccc1)=O
SPLASH splash10-0006-6954000000-41543ab1179993266d2d
Source of Spectrum F-52-4004-5
Wiley ID 795892