| SpectraBase Spectrum ID |
GOuKxXF4Isc |
| Name |
N-Butyl-2,3-dimethoxy-alpha-(trichlormethyl)benzylamine, hydrochloride |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
375.032639718 u |
| Formula |
C14H21Cl4NO2 |
| InChI |
InChI=1S/C14H20Cl3NO2.ClH/c1-4-5-9-18-13(14(15,16)17)10-7-6-8-11(19-2)12(10)20-3;/h6-8,13,18H,4-5,9H2,1-3H3;1H |
| InChIKey |
RTJCATOTWVQAPC-UHFFFAOYSA-N |
| Molecular Weight |
377.139 g/mol |
| SMILES |
N(C(C=1C=CC=C(C1OC)OC)C(Cl)(Cl)Cl)CCCC.Cl |
| Spectrum/Structure Validation Score (Raman) |
0.972655 |
