| SpectraBase Spectrum ID |
5ZiBPBt49BT |
| Name |
2,4-Dimethyl-5-[(4-methylpiperazin-1-yl)methyl]benzaldehyde |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
246.173213335 u |
| Formula |
C15H22N2O |
| InChI |
InChI=1S/C15H22N2O/c1-12-8-13(2)15(11-18)9-14(12)10-17-6-4-16(3)5-7-17/h8-9,11H,4-7,10H2,1-3H3 |
| InChIKey |
WTPRFYCTSCXCPW-UHFFFAOYSA-N |
| Molecular Weight |
246.354 g/mol |
| SMILES |
C1=C(C(CN2CCN(C)CC2)=CC(=C1C)C=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.947205 |
![2,4-Dimethyl-5-[(4-methylpiperazin-1-yl)methyl]benzaldehyde](/api/spectrum/5ZiBPBt49BT/structure.png?h=300&w=458 "2,4-Dimethyl-5-[(4-methylpiperazin-1-yl)methyl]benzaldehyde")
