| SpectraBase Spectrum ID |
GhZCUeTvvc9 |
| Name |
2-Hexyl-11,11-dimethyl-2-azatricyclo[6.4.0.0(1,6)]dodecane-3,9-dione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
305.235479240 u |
| Formula |
C19H31NO2 |
| InChI |
InChI=1S/C19H31NO2/c1-4-5-6-7-10-20-17(22)9-8-14-11-15-16(21)12-18(2,3)13-19(14,15)20/h14-15H,4-13H2,1-3H3/t14-,15+,19-/m1/s1 |
| InChIKey |
WQMZWMDMXMRDHA-ZRGWGRIASA-N |
| Molecular Weight |
305.462 g/mol |
| SMILES |
[C@]123[C@@](C(=O)CC(C3)(C)C)([H])C[C@]1(CCC(N2CCCCCC)=O)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.825137 |
![2-Hexyl-11,11-dimethyl-2-azatricyclo[6.4.0.0(1,6)]dodecane-3,9-dione](/api/spectrum/GhZCUeTvvc9/structure.png?h=300&w=458 "2-Hexyl-11,11-dimethyl-2-azatricyclo[6.4.0.0(1,6)]dodecane-3,9-dione")
