| SpectraBase Spectrum ID |
1Aj9stbVPwL |
| Name |
4-(Tert-butyl)-6-(methylthio)-1-azabicyclo[4.3.1]decan-10-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
255.165685602 u |
| Formula |
C14H25NOS |
| InChI |
InChI=1S/C14H25NOS/c1-13(2,3)11-6-9-15-8-5-7-14(10-11,17-4)12(15)16/h11H,5-10H2,1-4H3 |
| InChIKey |
ZZNXBWBGZGJYCV-UHFFFAOYSA-N |
| Molecular Weight |
255.420 g/mol |
| SMILES |
C1N2C(C(CC(C1)C(C)(C)C)(CCC2)SC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.875752 |
![4-(Tert-butyl)-6-(methylthio)-1-azabicyclo[4.3.1]decan-10-one](/api/spectrum/1Aj9stbVPwL/structure.png?h=300&w=458 "4-(Tert-butyl)-6-(methylthio)-1-azabicyclo[4.3.1]decan-10-one")
