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ACETYLHYDRAZONE_OF_ALPHA-(1-ACETYL-2-PHENYL-3-METHYL-5-PYRAZOLIDINYL)-ACETOACETIC_ESTER;DIASTEREOMER_1
SpectraBase Compound ID C5tVrCn63N
InChI InChI=1S/C20H28N4O4/c1-6-28-20(27)19(14(3)21-22-15(4)25)18-12-13(2)23(24(18)16(5)26)17-10-8-7-9-11-17/h7-11,13,18-19H,6,12H2,1-5H3,(H,22,25)/b21-14+/t13-,18+,19?/m0/s1
InChIKey FXJAUYYOVZCHIX-WAEDNIJISA-N
Mol Weight 388.47 g/mol
Molecular Formula C20H28N4O4
Exact Mass 388.211055 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KhzfL31YMgK
Name ACETYLHYDRAZONE_OF_ALPHA-(1-ACETYL-2-PHENYL-3-METHYL-5-PYRAZOLIDINYL)-ACETOACETIC_ESTER;DIASTEREOMER_1
Compound Number III-A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H28N4O4
InChI InChI=1S/C20H28N4O4/c1-6-28-20(27)19(14(3)21-22-15(4)25)18-12-13(2)23(24(18)16(5)26)17-10-8-7-9-11-17/h7-11,13,18-19H,6,12H2,1-5H3,(H,22,25)/b21-14+/t13-,18+,19?/m0/s1
InChIKey FXJAUYYOVZCHIX-WAEDNIJISA-N
Literature Reference Author L.A.SVIRIDOVA,G.A.GOLUBEVA,I.V.DLINNYKH,I.F.LESHCHEVA,V.N.NE STEROV
Literature Reference Citation CHEM.HET.COMP.,34,28(1998)
Literature Reference DOI 10.1007/bf02290717
Molecular Weight 388.467 g/mol
Solvent CDCl3
Source File Reference UWMZ15115