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1-[2-(2-Aminophenyl)-2oxoethyl]-4-[(1E)-3-(dimethylamino)-3-oxoprop-1-enyl]-1H-pyrrole-2-carboxylicacid methyl ester
SpectraBase Compound ID GkNCzqbchE6
InChI InChI=1S/C19H21N3O4/c1-21(2)18(24)9-8-13-10-16(19(25)26-3)22(11-13)12-17(23)14-6-4-5-7-15(14)20/h4-11H,12,20H2,1-3H3/b9-8+
InChIKey SPMHNHIICHJDBZ-CMDGGOBGSA-N
Mol Weight 355.39 g/mol
Molecular Formula C19H21N3O4
Exact Mass 355.153206 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KKyOzd3OWVG
Name 1-[2-(2-Aminophenyl)-2oxoethyl]-4-[(1E)-3-(dimethylamino)-3-oxoprop-1-enyl]-1H-pyrrole-2-carboxylicacid methyl ester
Appearance Colourless microcrystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H21N3O4
InChI InChI=1S/C19H21N3O4/c1-21(2)18(24)9-8-13-10-16(19(25)26-3)22(11-13)12-17(23)14-6-4-5-7-15(14)20/h4-11H,12,20H2,1-3H3/b9-8+
InChIKey SPMHNHIICHJDBZ-CMDGGOBGSA-N
Instrument Name JEOL JMS-AX 505W/Bruker Apex III
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0009.214
Molecular Weight 355.394 g/mol
Reported Formula C19H21N3O4
SMILES Nc1ccccc1C(C[n]1c(cc(c1)\C=C\C(=O)N(C)C)C(OC)=O)=O
SPLASH splash10-00di-1923000000-29988c7b2e0d09c3606f
Source of Spectrum ARK-2008-131-3h
Wiley ID 1869425