| SpectraBase Spectrum ID |
IE82OR1UMzD |
| Name |
9-Methyl-11-oxo-1,6-diazatricyclo[7.2.0.0(6,8)]undecane |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
180.126263142 u |
| Formula |
C10H16N2O |
| InChI |
InChI=1S/C10H16N2O/c1-10-6-9(13)12(10)5-3-2-4-11-7-8(10)11/h8H,2-7H2,1H3 |
| InChIKey |
QBMYOTQWIQTXIU-UHFFFAOYSA-N |
| Molecular Weight |
180.251 g/mol |
| SMILES |
C12(N(C(C2)=O)CCCCN2CC12)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.921588 |
![9-Methyl-11-oxo-1,6-diazatricyclo[7.2.0.0(6,8)]undecane](/api/spectrum/IE82OR1UMzD/structure.png?h=300&w=458 "9-Methyl-11-oxo-1,6-diazatricyclo[7.2.0.0(6,8)]undecane")
