| SpectraBase Spectrum ID |
rQkEVqd1KD |
| Name |
N-(9-Benzyl-9-azabicyclo[3.3.1]non-3-yl)-2,6- difluorobenzamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
370.185669726 u |
| Formula |
C22H24F2N2O |
| InChI |
InChI=1S/C22H24F2N2O/c23-19-10-5-11-20(24)21(19)22(27)25-16-12-17-8-4-9-18(13-16)26(17)14-15-6-2-1-3-7-15/h1-3,5-7,10-11,16-18H,4,8-9,12-14H2,(H,25,27)/t16-,17-,18+ |
| InChIKey |
BLVVOLNZWBXJGB-NNZMDNLPSA-N |
| Molecular Weight |
370.444 g/mol |
| SMILES |
[C@]12(N([C@](C[C@](C2)(NC(C2=C(C=CC=C2F)F)=O)[H])(CCC1)[H])CC1=CC=CC=C1)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.918889 |
![N-(9-Benzyl-9-azabicyclo[3.3.1]non-3-yl)-2,6- difluorobenzamide](/api/spectrum/rQkEVqd1KD/structure.png?h=300&w=458 "N-(9-Benzyl-9-azabicyclo[3.3.1]non-3-yl)-2,6- difluorobenzamide")
