| SpectraBase Spectrum ID |
N5q2JZENXg |
| Name |
2-Methyl-3-(8-methyl-3,8-diazabicyclo[3.2.1]octan-3-yl)propiophenone, dihydrochloride |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
344.142218864 u |
| Formula |
C17H26Cl2N2O |
| InChI |
InChI=1S/C17H24N2O.2ClH/c1-13(17(20)14-6-4-3-5-7-14)10-19-11-15-8-9-16(12-19)18(15)2;;/h3-7,13,15-16H,8-12H2,1-2H3;2*1H |
| InChIKey |
UOYYSMFTYYLFKP-UHFFFAOYSA-N |
| Molecular Weight |
345.314 g/mol |
| SMILES |
Cl.C=1C(=CC=CC1)C(C(CN1CC2CCC(C1)N2C)C)=O.Cl |
| Spectrum/Structure Validation Score (Raman) |
0.977483 |
![2-Methyl-3-(8-methyl-3,8-diazabicyclo[3.2.1]octan-3-yl)propiophenone, dihydrochloride](/api/spectrum/N5q2JZENXg/structure.png?h=300&w=458 "2-Methyl-3-(8-methyl-3,8-diazabicyclo[3.2.1]octan-3-yl)propiophenone, dihydrochloride")
