SpectraBase Spectrum ID |
9xwnQedQu8t |
Name |
1H-purine-7-ethanaminium, 2,3,6,7-tetrahydro-N-[(E)-[(4-methoxyphenyl)imino]methyl]-1,3-dimethyl-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 |
392.136366257 u |
Formula |
C17H21ClN6O3 |
InChI |
InChI=1S/C17H20N6O3.ClH/c1-21-15-14(16(24)22(2)17(21)25)23(11-20-15)9-8-18-10-19-12-4-6-13(26-3)7-5-12;/h4-7,10-11H,8-9H2,1-3H3,(H,18,19);1H |
InChIKey |
MGJPXWBUFMLAGY-UHFFFAOYSA-N |
Molecular Weight |
392.847 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_13334 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10260887; Lab Info: BEV; Lab Number: BEV-0000075 |