| SpectraBase Spectrum ID |
8Q5oGzjRteD |
| Name |
urea, N-(4-chlorophenyl)-N'-(3,4-dichlorophenyl)-N-[(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)methyl]- |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
463.073343383 u |
| Formula |
C21H20Cl3N5O |
| InChI |
InChI=1S/C21H20Cl3N5O/c22-14-5-8-16(9-6-14)29(21(30)25-15-7-10-17(23)18(24)12-15)13-20-27-26-19-4-2-1-3-11-28(19)20/h5-10,12H,1-4,11,13H2,(H,25,30) |
| InChIKey |
LBVYHFOFQQNAAI-UHFFFAOYSA-N |
| Molecular Weight |
464.784 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_6154 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/11221738; Lab Info: DEM; Lab Number: 0699 |
![N-(4-chlorophenyl)-N'-(3,4-dichlorophenyl)-N-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl)urea](/api/spectrum/8Q5oGzjRteD/structure.png?h=300&w=458 "N-(4-chlorophenyl)-N'-(3,4-dichlorophenyl)-N-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl)urea")
