| SpectraBase Spectrum ID |
GdlMZMAbjXQ |
| Name |
2,5-Dimethyl-3-[(2-methylpiperidin-1-yl)methyl]benzaldehyde |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
245.177964364 u |
| Formula |
C16H23NO |
| InChI |
InChI=1S/C16H23NO/c1-12-8-15(14(3)16(9-12)11-18)10-17-7-5-4-6-13(17)2/h8-9,11,13H,4-7,10H2,1-3H3 |
| InChIKey |
GIJVMIAPQDLJQR-UHFFFAOYSA-N |
| Molecular Weight |
245.366 g/mol |
| SMILES |
C1(=CC(CN2C(C)CCCC2)=C(C(=C1)C=O)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.966226 |
![2,5-Dimethyl-3-[(2-methylpiperidin-1-yl)methyl]benzaldehyde](/api/spectrum/GdlMZMAbjXQ/structure.png?h=300&w=458 "2,5-Dimethyl-3-[(2-methylpiperidin-1-yl)methyl]benzaldehyde")
