SpectraBase Spectrum ID |
4WA53lLuPgD |
Name |
N-(3-chlorophenyl)-2-(5-(3-chlorophenyl)-4,6-dioxo-4,5,6,6a-tetrahydropyrrolo[3,4-d][1,2,3]triazol-1(3aH)-yl)acetamide |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
417.039544696 u |
Formula |
C18H13Cl2N5O3 |
InChI |
InChI=1S/C18H13Cl2N5O3/c19-10-3-1-5-12(7-10)21-14(26)9-24-16-15(22-23-24)17(27)25(18(16)28)13-6-2-4-11(20)8-13/h1-8,15-16H,9H2,(H,21,26) |
InChIKey |
WNPXBWFDCIWSLA-UHFFFAOYSA-N |
Molecular Weight |
418.240 g/mol |
NMR Offset |
17.9985 |
NMR Spectrometer Frequency |
500.136 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2020_9766 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/13229808 |