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4-(Ethoxycarbonyl)-1-(N-phenylureido)-3-propargyl-2,5-dimethylpyrrole
SpectraBase Compound ID De515Nscihk
InChI InChI=1S/C19H21N3O3/c1-5-10-16-13(3)21(14(4)17(16)18(23)25-6-2)22(19(20)24)15-11-8-7-9-12-15/h1,7-9,11-12H,6,10H2,2-4H3,(H2,20,24)
InChIKey FJVUQCOPXZOKHU-UHFFFAOYSA-N
Mol Weight 339.4 g/mol
Molecular Formula C19H21N3O3
Exact Mass 339.158292 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HrB7fnqe1Ud
Name 4-(Ethoxycarbonyl)-1-(N-phenylureido)-3-propargyl-2,5-dimethylpyrrole
Alternate Name(s) Ethyl 1-[(aminocarbonyl)anilino]-2,5-dimethyl-4-(2-propynyl)-1H-pyrrole-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H21N3O3
InChI InChI=1S/C19H21N3O3/c1-5-10-16-13(3)21(14(4)17(16)18(23)25-6-2)22(19(20)24)15-11-8-7-9-12-15/h1,7-9,11-12H,6,10H2,2-4H3,(H2,20,24)
InChIKey FJVUQCOPXZOKHU-UHFFFAOYSA-N
Molecular Weight 339.395 g/mol
SMILES NC(N([n]1c(c(C(=O)OCC)c(c1C)CC#C)C)c1ccccc1)=O
SPLASH splash10-00kf-9707000000-fcb649011f2c76ca32d9
Source of Spectrum F-52-4007-12
Wiley ID 795886