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1-(2-CYANOETHYL)-3-METHYL-4-(1-ACETYL-2-PHENYL-3-METHYLPYRAZOLIDIN-5-YL)-PYRAZOL-5-ONE
SpectraBase Compound ID 4tsovqLhHEF
InChI InChI=1S/C19H23N5O2/c1-13-12-17(18-14(2)21-22(19(18)26)11-7-10-20)24(15(3)25)23(13)16-8-5-4-6-9-16/h4-6,8-9,13,17-18H,7,11-12H2,1-3H3/t13-,17+,18?/m0/s1
InChIKey NLHGPILJWGSONE-DQAFQZJZSA-N
Mol Weight 353.43 g/mol
Molecular Formula C19H23N5O2
Exact Mass 353.185175 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ACxjDZJtvvb
Name 1-(2-CYANOETHYL)-3-METHYL-4-(1-ACETYL-2-PHENYL-3-METHYLPYRAZOLIDIN-5-YL)-PYRAZOL-5-ONE
Compound Number III-H
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H23N5O2
InChI InChI=1S/C19H23N5O2/c1-13-12-17(18-14(2)21-22(19(18)26)11-7-10-20)24(15(3)25)23(13)16-8-5-4-6-9-16/h4-6,8-9,13,17-18H,7,11-12H2,1-3H3/t13-,17+,18?/m0/s1
InChIKey NLHGPILJWGSONE-DQAFQZJZSA-N
Literature Reference Author L.A.SVIRIDOVA,G.A.GOLUBEVA,I.V.DLINNYKH,I.F.LESHCHEVA,L.D.AS HKINADZE,V.V.NESTERO
Literature Reference Citation CHEM.HET.COMP.,34,929(1998)
Literature Reference DOI 10.1007/bf02311329
Molecular Weight 353.424 g/mol
Solvent CDCl3
Source File Reference UWMZ14603