SpectraBase Spectrum ID |
4sBuSWy6ePC |
Name |
9-Acetamido-1-phenyl-3,6-diazahomoadamantane |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
285.184112372 u |
Formula |
C17H23N3O |
InChI |
InChI=1S/C17H23N3O/c1-13(21)18-16-14-9-19-7-8-20(10-14)12-17(16,11-19)15-5-3-2-4-6-15/h2-6,14,16H,7-12H2,1H3,(H,18,21)/t14-,16?,17+ |
InChIKey |
DQAMRSJECIWARC-FHQBBSRKSA-N |
SMILES |
C1N2CCN3C[C@]1(C([C@@](C3)(C2)[H])NC(=O)C)C1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.970962 |