| SpectraBase Spectrum ID |
3LmAcKb3x21 |
| Name |
1-{[2-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl)ethyl]amino}cycloheptan-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 |
354.157101703 u |
| Formula |
C15H23ClN6O2 |
| InChI |
InChI=1S/C15H22N6O2.ClH/c1-19-13-12(14(22)20(2)15(19)23)21(10-18-13)9-8-17-11-6-4-3-5-7-16-11;/h10H,3-9H2,1-2H3,(H,16,17);1H |
| InChIKey |
ZGEWUIYGQDRNGB-UHFFFAOYSA-N |
| Molecular Weight |
354.842 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_15278 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/11240712; Lab Info: BEV; Lab Number: BEV-0000011 |
![1-{[2-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl)ethyl]amino}cycloheptan-1-ylium chloride](/api/spectrum/3LmAcKb3x21/structure.png?h=300&w=458 "1-{[2-(1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-7-yl)ethyl]amino}cycloheptan-1-ylium chloride")
