| SpectraBase Compound ID | DUa1qvPDTKd |
|---|---|
| InChI | InChI=1S/C17H20N4O2/c1-17(2,11-6-4-3-5-7-11)14-16(23)20-13(15(22)21-14)8-12-9-18-10-19-12/h3-7,9-10,13-14H,8H2,1-2H3,(H,18,19)(H,20,23)(H,21,22)/t13-,14+/m1/s1 |
| InChIKey | PQYNAABAKRNLRW-KGLIPLIRSA-N |
| Mol Weight | 312.37 g/mol |
| Molecular Formula | C17H20N4O2 |
| Exact Mass | 312.158626 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | J0SPWSoRCBS |
|---|---|
| Name | (3S,CIS)-3-(1H-IMIDAZOL-4-YL-METHYL)-6-((1-METHYL-1-PHENYL)-ETHYL)-PIPERAZINE-2,5-DION |
| Compound Number | 7 |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C17H20N4O2 |
| InChI | InChI=1S/C17H20N4O2/c1-17(2,11-6-4-3-5-7-11)14-16(23)20-13(15(22)21-14)8-12-9-18-10-19-12/h3-7,9-10,13-14H,8H2,1-2H3,(H,18,19)(H,20,23)(H,21,22)/t13-,14+/m1/s1 |
| InChIKey | PQYNAABAKRNLRW-KGLIPLIRSA-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 | 312.371 g/mol |
| Solvent | DMSO |
| Source File Reference | UWRJ37 |