| SpectraBase Spectrum ID |
Gg6VYv4JDjF |
| Name |
1-({2-oxo-3-[3-(trifluoromethyl)phenyl]propyl}sulfanyl)cyclopentan-1-ylium chloride |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
339.041995413 u |
| Formula |
C12H13ClF3N3OS |
| InChI |
InChI=1S/C12H12F3N3OS.ClH/c13-12(14,15)8-2-1-3-9(6-8)18-10(19)7-20-11-16-4-5-17-11;/h1-3,6H,4-5,7H2,(H,16,17)(H,18,19);1H |
| InChIKey |
UZLHUCWIPQUUIT-UHFFFAOYSA-N |
| Molecular Weight |
339.764 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_18242 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/11211102; Lab Info: DEM; Lab Number: 0466 |
![1-({2-oxo-3-[3-(trifluoromethyl)phenyl]propyl}sulfanyl)cyclopentan-1-ylium chloride](/api/spectrum/Gg6VYv4JDjF/structure.png?h=300&w=458 "1-({2-oxo-3-[3-(trifluoromethyl)phenyl]propyl}sulfanyl)cyclopentan-1-ylium chloride")
