| SpectraBase Spectrum ID |
AW4DgSUuMug |
| Name |
5-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-3-[2-(4-fluorophenyl)-2-oxoethyl]-2-(4-pyridinyl)-1,3,4-oxadiazol-3-ium 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/C21H21FN3O3S.BrH/c1-21(2,3)18(27)13-29-20-24-25(19(28-20)15-8-10-23-11-9-15)12-17(26)14-4-6-16(22)7-5-14;/h4-11H,12-13H2,1-3H3;1H/q+1;/p-1 |
| InChIKey |
XYOVCWJDYXQPKZ-UHFFFAOYSA-M |
| NMR Offset |
15.328 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Origin |
1H_UBI-VK_18310_15182 |
| 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: 987/00001488; Labnumber: 987/00001488218817; VK_ID: VK-015187 |
| Temperature |
318 °C |
![5-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-3-[2-(4-fluorophenyl)-2-oxoethyl]-2-(4-pyridinyl)-1,3,4-oxadiazol-3-ium bromide](/api/spectrum/AW4DgSUuMug/structure.png?h=300&w=458 "5-[(3,3-dimethyl-2-oxobutyl)sulfanyl]-3-[2-(4-fluorophenyl)-2-oxoethyl]-2-(4-pyridinyl)-1,3,4-oxadiazol-3-ium bromide")
