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1-(3,5-dioxo-4-phenyl-1H-pyrazolecarbonyl)-1-cyclopentanoic acid ethyl ester
SpectraBase Compound ID K1wU4ogKIxo
InChI InChI=1S/C18H20N2O5/c1-2-25-17(24)18(10-6-7-11-18)16(23)20-15(22)13(14(21)19-20)12-8-4-3-5-9-12/h3-5,8-9,13H,2,6-7,10-11H2,1H3,(H,19,21)
InChIKey UXQZWWHGJBIIRH-UHFFFAOYSA-N
Mol Weight 344.37 g/mol
Molecular Formula C18H20N2O5
Exact Mass 344.137222 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KasdXIgLi5q
Name 1-(3,5-dioxo-4-phenyl-1H-pyrazolecarbonyl)-1-cyclopentanoic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20N2O5
InChI InChI=1S/C18H20N2O5/c1-2-25-17(24)18(10-6-7-11-18)16(23)20-15(22)13(14(21)19-20)12-8-4-3-5-9-12/h3-5,8-9,13H,2,6-7,10-11H2,1H3,(H,19,21)
InChIKey UXQZWWHGJBIIRH-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cber.19751080705
Molecular Weight 344.367 g/mol
SMILES N1N(C(C(C1=O)c1ccccc1)=O)C(=O)C1(C(OCC)=O)CCCC1
SPLASH splash10-00kg-0933000000-5a308c78dfef96444a34
Source of Spectrum K-108-2200-7Bi
Synonyms Ethyl 1-(3,5-dioxo-4-phenylpyrazolidine-1-carbonyl)cyclopentane-1-carboxylate
Wiley ID 1793979