| SpectraBase Spectrum ID |
4A0mzwJZ9f3 |
| Name |
Ethanone, 1-(4,5-diethyl-2-methyl-1-cyclopenten-1-yl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
180.151415263 u |
| Formula |
C12H20O |
| InChI |
InChI=1S/C12H20O/c1-5-10-7-8(3)12(9(4)13)11(10)6-2/h10-11H,5-7H2,1-4H3 |
| InChIKey |
DBGUPVIBNLDIII-UHFFFAOYSA-N |
| Molecular Weight |
180.291 g/mol |
| SMILES |
C(C)C1C(C(C)=O)=C(C)CC1CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.901771 |
