| SpectraBase Spectrum ID |
HxnjP10Q3YN |
| Name |
L-alpha-Acetylmethadol HC l inkbr |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
389.212156972 u |
| Formula |
C23H32ClNO2 |
| InChI |
InChI=1S/C23H31NO2.ClH/c1-6-22(26-19(3)25)23(17-18(2)24(4)5,20-13-9-7-10-14-20)21-15-11-8-12-16-21;/h7-16,18,22H,6,17H2,1-5H3;1H/t18-,22-;/m1./s1 |
| InChIKey |
UXBPQRGCVJOTNT-TVNLMDKXSA-N |
| Molecular Weight |
389.967 g/mol |
| SMILES |
C[C@@](CC(C=1C=CC=CC1)(C1=CC=CC=C1)[C@@](OC(=O)C)([H])CC)([H])N(C)C.Cl |
| Spectrum/Structure Validation Score (Raman) |
0.989887 |
