| SpectraBase Spectrum ID |
J5Tn0Cupwav |
| Name |
1H-azepine, 1-[5-[4-(2,6-difluorobenzoyl)-1-piperazinyl]-2-fluoro-4-nitrophenyl]hexahydro- |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
462.187875167 u |
| Formula |
C23H25F3N4O3 |
| InChI |
InChI=1S/C23H25F3N4O3/c24-16-6-5-7-17(25)22(16)23(31)29-12-10-28(11-13-29)20-15-19(18(26)14-21(20)30(32)33)27-8-3-1-2-4-9-27/h5-7,14-15H,1-4,8-13H2 |
| InChIKey |
PGNMHVLNSYSKNS-UHFFFAOYSA-N |
| Molecular Weight |
462.473 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_17165 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/11252808; Lab Info: LIP; Lab Number: LIP-0501746 |
![1H-azepine, 1-[5-[4-(2,6-difluorobenzoyl)-1-piperazinyl]-2-fluoro-4-nitrophenyl]hexahydro-](/api/spectrum/J5Tn0Cupwav/structure.png?h=300&w=458 "1H-azepine, 1-[5-[4-(2,6-difluorobenzoyl)-1-piperazinyl]-2-fluoro-4-nitrophenyl]hexahydro-")
