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4-(1-BENZYLAMINOPROPYLIDENE)-1-(N-HEXYL)-3-METHYL-2-PYRAZOLIN-5-ONE

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4-(1-BENZYLAMINOPROPYLIDENE)-1-(N-HEXYL)-3-METHYL-2-PYRAZOLIN-5-ONE
SpectraBase Compound ID EPK1wvQRQcW
InChI InChI=1S/C20H29N3O/c1-4-6-7-11-14-23-20(24)19(16(3)22-23)18(5-2)21-15-17-12-9-8-10-13-17/h8-10,12-13,21H,4-7,11,14-15H2,1-3H3/b19-18+
InChIKey IHXPJFYRIANTHT-VHEBQXMUSA-N
Mol Weight 327.47 g/mol
Molecular Formula C20H29N3O
Exact Mass 327.231063 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CRCfBtU1ubT
Name 4-(1-BENZYLAMINOPROPYLIDENE)-1-(N-HEXYL)-3-METHYL-2-PYRAZOLIN-5-ONE
Compound Number 5J
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H29N3O
InChI InChI=1S/C20H29N3O/c1-4-6-7-11-14-23-20(24)19(16(3)22-23)18(5-2)21-15-17-12-9-8-10-13-17/h8-10,12-13,21H,4-7,11,14-15H2,1-3H3/b19-18+
InChIKey IHXPJFYRIANTHT-VHEBQXMUSA-N
Literature Reference Author J.BELMAR,F.R.PEREZ,J.ALDERETE,C.ZUNIGA
Literature Reference Citation J.BRAZ.CHEM.SOC.,16,179(2005)
Molecular Weight 327.470 g/mol
Solvent CDCl3
Source File Reference UWLU7087