| SpectraBase Spectrum ID |
LK0WqA0uwVD |
| Name |
1-Phenyl-3,6-diazahomoadamantan-9-ol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
244.157563271 u |
| Formula |
C15H20N2O |
| InChI |
InChI=1S/C15H20N2O/c18-14-12-8-16-6-7-17(9-12)11-15(14,10-16)13-4-2-1-3-5-13/h1-5,12,14,18H,6-11H2/t12-,14?,15+ |
| InChIKey |
MNRUFFKCDYALGA-NNUVIIOVSA-N |
| Molecular Weight |
244.338 g/mol |
| SMILES |
C1N2CCN3C[C@]1(C([C@@](C3)(C2)[H])O)C1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.82491 |
