| SpectraBase Spectrum ID |
59YkY8QTAii |
| Name |
1-(1-Adamantylcarbonyl)piperazine, me derivative |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
262.204513464 u |
| Formula |
C16H26N2O |
| InChI |
InChI=1S/C16H26N2O/c1-17-2-4-18(5-3-17)15(19)16-9-12-6-13(10-16)8-14(7-12)11-16/h12-14H,2-11H2,1H3 |
| InChIKey |
NINBPJOROIHPNH-UHFFFAOYSA-N |
| Molecular Weight |
262.397 g/mol |
| SMILES |
C1N(CCN(C1)C)C(=O)C12CC3CC(C2)CC(C1)C3 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.968396 |
