| SpectraBase Spectrum ID |
DGPjFgio4Pc |
| Name |
2-[(4-Ethylpiperidino)methyl]-4,5-dimethylphenol, hydrochloride |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
283.170292160 u |
| Formula |
C16H26ClNO |
| InChI |
InChI=1S/C16H25NO.ClH/c1-4-14-5-7-17(8-6-14)11-15-9-12(2)13(3)10-16(15)18;/h9-10,14,18H,4-8,11H2,1-3H3;1H |
| InChIKey |
XKNRCTDPZFULSV-UHFFFAOYSA-N |
| Molecular Weight |
283.843 g/mol |
| SMILES |
Cl.OC=1C(=CC(=C(C1)C)C)CN1CCC(CC1)CC |
| Spectrum/Structure Validation Score (Raman) |
0.987485 |
![2-[(4-Ethylpiperidino)methyl]-4,5-dimethylphenol, hydrochloride](/api/spectrum/DGPjFgio4Pc/structure.png?h=300&w=458 "2-[(4-Ethylpiperidino)methyl]-4,5-dimethylphenol, hydrochloride")
