| SpectraBase Spectrum ID |
8JDesofLWUM |
| Name |
1,1'-bis(2-oxo-2-phenylethyl)-6,6',7,7',8,8',9,9'-octahydro-5H,5'H-[3,3'-bi[1,2,4]triazolo[4,3-a]azepine]-1,1'-diium bromide |
| Author |
A.V.Yarkov, IPAC, Russia |
| Copyright |
Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI |
InChI=1S/C30H34N6O2.2BrH/c37-25(23-13-5-1-6-14-23)21-35-27-17-9-3-11-19-33(27)29(31-35)30-32-36(28-18-10-4-12-20-34(28)30)22-26(38)24-15-7-2-8-16-24;;/h1-2,5-8,13-16H,3-4,9-12,17-22H2;2*1H/q+2;;/p-2 |
| InChIKey |
RSUFJPNJTXYLQO-UHFFFAOYSA-L |
| NMR Offset |
15.3537 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Origin |
1H_UBI-VK_18310_5974 |
| Owner |
Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc. |
| Sample State |
soluted |
| Solvent |
DMSO-d6 |
| Source File Reference |
VendorID: 121888; Labnumber: EX00112341; VK_ID: VK-005977 |
| Temperature |
308 °C |
![1,1'-bis(2-oxo-2-phenylethyl)-6,6',7,7',8,8',9,9'-octahydro-5H,5'H-[3,3'-bi[1,2,4]triazolo[4,3-a]azepine]-1,1'-diium bromide](/api/spectrum/8JDesofLWUM/structure.png?h=300&w=458 "1,1'-bis(2-oxo-2-phenylethyl)-6,6',7,7',8,8',9,9'-octahydro-5H,5'H-[3,3'-bi[1,2,4]triazolo[4,3-a]azepine]-1,1'-diium bromide")
