| SpectraBase Spectrum ID |
117A6DVDyCP |
| Name |
2-(5-(3-chlorophenyl)-4,6-dioxo-4,5,6,6a-tetrahydropyrrolo[3,4-d][1,2,3]triazol-1(3aH)-yl)-N-(4-ethylphenyl)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 |
411.109817157 u |
| Formula |
C20H18ClN5O3 |
| InChI |
InChI=1S/C20H18ClN5O3/c1-2-12-6-8-14(9-7-12)22-16(27)11-25-18-17(23-24-25)19(28)26(20(18)29)15-5-3-4-13(21)10-15/h3-10,17-18H,2,11H2,1H3,(H,22,27) |
| InChIKey |
LGDXRHCKEQCRIU-UHFFFAOYSA-N |
| Molecular Weight |
411.849 g/mol |
| NMR Offset |
17.9982 |
| NMR Spectrometer Frequency |
500.136 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2020_9786 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/13229829 |
![2-(5-(3-chlorophenyl)-4,6-dioxo-4,5,6,6a-tetrahydropyrrolo[3,4-d][1,2,3]triazol-1(3aH)-yl)-N-(4-ethylphenyl)acetamide](/api/spectrum/117A6DVDyCP/structure.png?h=300&w=458 "2-(5-(3-chlorophenyl)-4,6-dioxo-4,5,6,6a-tetrahydropyrrolo[3,4-d][1,2,3]triazol-1(3aH)-yl)-N-(4-ethylphenyl)acetamide")
