SpectraBase Spectrum ID |
6nbSjLZzgsn |
Name |
3,4,5-Trimethoxyamphetamine HC l inkbr |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
261.113171205 u |
Formula |
C12H20ClNO3 |
InChI |
InChI=1S/C12H19NO3.ClH/c1-8(13)5-9-6-10(14-2)12(16-4)11(7-9)15-3;/h6-8H,5,13H2,1-4H3;1H |
InChIKey |
GOAXEHDWLMGWIV-UHFFFAOYSA-N |
Molecular Weight |
261.749 g/mol |
SMILES |
NC(CC1=CC(=C(C(=C1)OC)OC)OC)C.Cl |
Spectrum/Structure Validation Score (Raman) |
0.975811 |