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(3S,CIS)-3-DIPHENYLMETHYL-6-(1H-IMIDAZOLE-4-YL-METHYL)-PIPERAZINE-2,5-DION
SpectraBase Compound ID GpxaPpFb5gk
InChI InChI=1S/C21H20N4O2/c26-20-17(11-16-12-22-13-23-16)24-21(27)19(25-20)18(14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-10,12-13,17-19H,11H2,(H,22,23)(H,24,27)(H,25,26)/t17-,19-/m1/s1
InChIKey MYLWACSPTWGZHC-IEBWSBKVSA-N
Mol Weight 360.42 g/mol
Molecular Formula C21H20N4O2
Exact Mass 360.158626 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6UP651QRwEd
Name (3S,CIS)-3-DIPHENYLMETHYL-6-(1H-IMIDAZOLE-4-YL-METHYL)-PIPERAZINE-2,5-DION
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H20N4O2
InChI InChI=1S/C21H20N4O2/c26-20-17(11-16-12-22-13-23-16)24-21(27)19(25-20)18(14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-10,12-13,17-19H,11H2,(H,22,23)(H,24,27)(H,25,26)/t17-,19-/m1/s1
InChIKey MYLWACSPTWGZHC-IEBWSBKVSA-N
Literature Reference Author CR.NOE,A.WEIGAND,S.PIRKER,P.LIEPERT
Literature Reference Citation MH.CHEM.,128,301(1997)
Literature Reference DOI 10.1007/BF00807896
Molecular Weight 360.415 g/mol
Solvent DMSO
Source File Reference UWRJ36