| SpectraBase Spectrum ID |
4QFmBktyo73 |
| Name |
N-(1-Adamantyl)-4-benzhydryl-1-piperazinecarboxamide |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
429.278012758 u |
| Formula |
C28H35N3O |
| InChI |
InChI=1S/C28H35N3O/c32-27(29-28-18-21-15-22(19-28)17-23(16-21)20-28)31-13-11-30(12-14-31)26(24-7-3-1-4-8-24)25-9-5-2-6-10-25/h1-10,21-23,26H,11-20H2,(H,29,32)/t21-,22+,23-,28- |
| InChIKey |
BGENOXQYKVQKTQ-VQAWQBJASA-N |
| Molecular Weight |
429.608 g/mol |
| SMILES |
N(C(=O)N1CCN(C(C=2C=CC=CC2)C2=CC=CC=C2)CC1)C12C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H] |
