| SpectraBase Spectrum ID |
7iTLm4I8J4a |
| Name |
3,7-di-Tert-butyl-1,5-di(phenylmethyl)-3,7-diazabicyclo[3,3,1]nonan-9-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
432.314063915 u |
| Formula |
C29H40N2O |
| InChI |
InChI=1S/C29H40N2O/c1-26(2,3)30-19-28(17-23-13-9-7-10-14-23)21-31(27(4,5)6)22-29(20-30,25(28)32)18-24-15-11-8-12-16-24/h7-16H,17-22H2,1-6H3/t28-,29+ |
| InChIKey |
VLTMGZQSIOOUIW-ISILISOKSA-N |
| Molecular Weight |
432.652 g/mol |
| SMILES |
C1[C@]2(CN(C[C@](C2=O)(CN1C(C)(C)C)CC1=CC=CC=C1)C(C)(C)C)CC1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.938838 |
![3,7-di-Tert-butyl-1,5-di(phenylmethyl)-3,7-diazabicyclo[3,3,1]nonan-9-one](/api/spectrum/7iTLm4I8J4a/structure.png?h=300&w=458 "3,7-di-Tert-butyl-1,5-di(phenylmethyl)-3,7-diazabicyclo[3,3,1]nonan-9-one")
