| SpectraBase Spectrum ID |
3t3GQNL20ed |
| Name |
1-[2-(4-methoxyphenyl)-2-oxoethyl]-4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)pyridinium 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/C21H23N4O2.BrH/c1-27-18-8-6-16(7-9-18)19(26)15-24-13-10-17(11-14-24)21-23-22-20-5-3-2-4-12-25(20)21;/h6-11,13-14H,2-5,12,15H2,1H3;1H/q+1;/p-1 |
| InChIKey |
SWIADBPGFBEWGU-UHFFFAOYSA-M |
| NMR Offset |
15.328 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Origin |
1H_UBI-VK_18310_5887 |
| 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: 121782; Labnumber: EX00112085; VK_ID: VK-005890 |
| Temperature |
318 °C |
![1-[2-(4-methoxyphenyl)-2-oxoethyl]-4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)pyridinium bromide](/api/spectrum/3t3GQNL20ed/structure.png?h=300&w=458 "1-[2-(4-methoxyphenyl)-2-oxoethyl]-4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)pyridinium bromide")
