| SpectraBase Spectrum ID |
8T1kG9ZVZTu |
| Name |
2,3,4,5-Tetrapropylcyclopent-2-en-1-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
250.229665585 u |
| Formula |
C17H30O |
| InChI |
InChI=1S/C17H30O/c1-5-9-13-14(10-6-2)16(12-8-4)17(18)15(13)11-7-3/h13,15H,5-12H2,1-4H3 |
| InChIKey |
MBNGWKREFHKKMO-UHFFFAOYSA-N |
| Molecular Weight |
250.426 g/mol |
| SMILES |
C1(=C(C(CCC)C(C1=O)CCC)CCC)CCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.803854 |
