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1-[3-(Ethoxycarbonyl)-1-phenyl-1H-pyrazol-5-yl]-4-ethyl(E)-2-butenedioate
SpectraBase Compound ID 8xXTmWPA72F
InChI InChI=1S/C18H18N2O6/c1-3-24-16(21)10-11-17(22)26-15-12-14(18(23)25-4-2)19-20(15)13-8-6-5-7-9-13/h5-12H,3-4H2,1-2H3/b11-10+
InChIKey LYYUMFPAHXOKBO-ZHACJKMWSA-N
Mol Weight 358.35 g/mol
Molecular Formula C18H18N2O6
Exact Mass 358.116486 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8zxaxdRk0On
Name 1-[3-(Ethoxycarbonyl)-1-phenyl-1H-pyrazol-5-yl]-4-ethyl(E)-2-butenedioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18N2O6
InChI InChI=1S/C18H18N2O6/c1-3-24-16(21)10-11-17(22)26-15-12-14(18(23)25-4-2)19-20(15)13-8-6-5-7-9-13/h5-12H,3-4H2,1-2H3/b11-10+
InChIKey LYYUMFPAHXOKBO-ZHACJKMWSA-N
Molecular Weight 358.350 g/mol
SMILES c1([n](nc(c1)C(=O)OCC)-c1ccccc1)OC(\C=C\C(=O)OCC)=O
SPLASH splash10-057m-9440000000-1f3f199e8386ec43b20d
Source of Spectrum F-67-4599-9b
Wiley ID 1686683