SpectraBase Spectrum ID |
6JSiK0WtXm7 |
Name |
2,6-Dimethyl-9-(1-methylethyl)-1-cyclodecanone |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
224.214015521 u |
Formula |
C15H28O |
InChI |
InChI=1S/C15H28O/c1-11(2)14-9-8-12(3)6-5-7-13(4)15(16)10-14/h11-14H,5-10H2,1-4H3 |
InChIKey |
ZGYUWSOTQWWIPC-UHFFFAOYSA-N |
Molecular Weight |
224.388 g/mol |
SMILES |
C1CC(CC(C(C)CCCC1C)=O)C(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.922012 |