| SpectraBase Spectrum ID |
i68dk7XQjE |
| Name |
1-(4-((4-Chlorophenyl)(phenyl)methyl)piperazin-1-yl)hexane-1,2-dione |
| Appearance |
Colorless oil |
| Carrier Gas |
Argon |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
398.176105815 u |
| Formula |
C23H27ClN2O2 |
| InChI |
InChI=1S/C23H27ClN2O2/c1-2-3-9-21(27)23(28)26-16-14-25(15-17-26)22(18-7-5-4-6-8-18)19-10-12-20(24)13-11-19/h4-8,10-13,22H,2-3,9,14-17H2,1H3 |
| InChIKey |
NRQRXEOFTHPBOQ-UHFFFAOYSA-N |
| Instrument Name |
AMD 402 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.202200062 |
| Molecular Weight |
398.934 g/mol |
| Quality |
149 |
| Reported Formula |
C23H27ClN2O2 |
| SMILES |
C1N(C(C(CCCC)=O)=O)CCN(C1)C(C1=CC=CC=C1)C1=CC=C(C=C1)Cl |
| SPLASH |
splash10-0uy0-4491000000-089b41e496f825085c74 |
| Source of Spectrum |
ACI-61-SM20-3y (DOI: 10.1002/anie.202200062) |
| Thin-Layer Chromatography |
0.2 (pentane/EA, 5:1) |
| Wiley ID |
1897604 |
