SpectraBase Spectrum ID |
8RRj8T45eV2 |
Name |
1H-purine-7-ethanaminium, 2,3,6,7-tetrahydro-1,3-dimethyl-N-[(2E)-1-methylpiperidinylidene]-2,6-dioxo-, 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/c1-18-8-5-4-6-11(18)16-7-9-21-10-17-13-12(21)14(22)20(3)15(23)19(13)2;/h10H,4-9H2,1-3H3;1H/b16-11+; |
InChIKey |
UJKNOFCWFCLNIZ-YFMOEUEHSA-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_12904 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10260872; Lab Info: BEV; Lab Number: BEV-0000058 |