| SpectraBase Spectrum ID |
A1qAz7LWydo |
| Name |
3-Azabicyclo[3.3.1]nonane-7-carboxamide, N-(2-anthracenyl)-1,5,7-trimethyl-2,4-dioxo- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
414.194342702 u |
| Formula |
C26H26N2O3 |
| InChI |
InChI=1S/C26H26N2O3/c1-24(13-25(2)15-26(3,14-24)23(31)28-22(25)30)21(29)27-20-9-8-18-10-16-6-4-5-7-17(16)11-19(18)12-20/h4-12H,13-15H2,1-3H3,(H,27,29)(H,28,30,31)/t24-,25+,26- |
| InChIKey |
MNGPUFGLQTWLGD-OOSCYNTBSA-N |
| Molecular Weight |
414.505 g/mol |
| SMILES |
[C@]1(C[C@@]2(C[C@](C1)(C(NC2=O)=O)C)C)(C(NC=1C=CC2=CC3=CC=CC=C3C=C2C1)=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.936232 |
![3-Azabicyclo[3.3.1]nonane-7-carboxamide, N-(2-anthracenyl)-1,5,7-trimethyl-2,4-dioxo-](/api/spectrum/A1qAz7LWydo/structure.png?h=300&w=458 "3-Azabicyclo[3.3.1]nonane-7-carboxamide, N-(2-anthracenyl)-1,5,7-trimethyl-2,4-dioxo-")
