| SpectraBase Spectrum ID |
L8rQLF3JJSk |
| Name |
1-Benzyl-2-(2-methylpropyl)cyclopentane-1-carbaldehyde |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
244.182715392 u |
| Formula |
C17H24O |
| InChI |
InChI=1S/C17H24O/c1-14(2)11-16-9-6-10-17(16,13-18)12-15-7-4-3-5-8-15/h3-5,7-8,13-14,16H,6,9-12H2,1-2H3 |
| InChIKey |
LCZMGBIAUHAYSH-UHFFFAOYSA-N |
| Molecular Weight |
244.378 g/mol |
| SMILES |
C1(C(CCC1)CC(C)C)(C=O)CC=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.839853 |
