SpectraBase Spectrum ID |
3lHi6eOUuQ4 |
Name |
1-benzyl-N-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-nitro-3-oxido-2H-1,2,3-triazol-4-yl]-4-piperidinamine |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
452.180817892 u |
Formula |
C22H24N6O5 |
InChI |
InChI=1S/C22H24N6O5/c29-27-21(23-17-8-10-25(11-9-17)15-16-4-2-1-3-5-16)22(28(30)31)24-26(27)18-6-7-19-20(14-18)33-13-12-32-19/h1-7,14,17,23H,8-13,15H2 |
InChIKey |
CFIAQBPIOTUCGK-UHFFFAOYSA-N |
Molecular Weight |
452.471 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2020_5133 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/12318397 |