| SpectraBase Spectrum ID |
8SsivcO4U7x |
| Name |
(Cyclopentenyl-1-carbonyl)-4-propyl-hept-3-ene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
234.198365456 u |
| Formula |
C16H26O |
| InChI |
InChI=1S/C16H26O/c1-3-8-14(9-4-2)10-7-13-16(17)15-11-5-6-12-15/h10-11H,3-9,12-13H2,1-2H3 |
| InChIKey |
PMQNNGUONQLTKG-UHFFFAOYSA-N |
| Molecular Weight |
234.383 g/mol |
| SMILES |
C(C1=CCCC1)(CCC=C(CCC)CCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.859195 |
