| SpectraBase Spectrum ID |
HrfqFYP5bme |
| Name |
N-(8-Methyl-8-azabicyclo[3.2.1]oct-3-yl)-2-(phenylsulfanyl)acetamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
290.145284509 u |
| Formula |
C16H22N2OS |
| InChI |
InChI=1S/C16H22N2OS/c1-18-13-7-8-14(18)10-12(9-13)17-16(19)11-20-15-5-3-2-4-6-15/h2-6,12-14H,7-11H2,1H3,(H,17,19)/t12-,13+,14- |
| InChIKey |
CYOVOIGRSWHWMP-BTTYYORXSA-N |
| SMILES |
C1(=CC=CC=C1)SCC(N[C@]1(C[C@@]2(N(C)[C@](C1)(CC2)[H])[H])[H])=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.890063 |
![N-(8-Methyl-8-azabicyclo[3.2.1]oct-3-yl)-2-(phenylsulfanyl)acetamide](/api/spectrum/HrfqFYP5bme/structure.png?h=300&w=458 "N-(8-Methyl-8-azabicyclo[3.2.1]oct-3-yl)-2-(phenylsulfanyl)acetamide")
