| SpectraBase Spectrum ID |
CYsZmozoPqV |
| Name |
3-Cyclohexene-1-carboxaldehyde, 4-(4-methyl-3-pentenyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
192.151415263 u |
| Formula |
C13H20O |
| InChI |
InChI=1S/C13H20O/c1-11(2)4-3-5-12-6-8-13(10-14)9-7-12/h4,6,10,13H,3,5,7-9H2,1-2H3 |
| InChIKey |
MQBIZQLCHSZBOI-UHFFFAOYSA-N |
| Molecular Weight |
192.302 g/mol |
| SMILES |
C(C=C(C)C)CC1=CCC(C=O)CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.918479 |
