SpectraBase Spectrum ID |
DMdqfqREEA9 |
Name |
6-isobutyl-2-{[1-(4-methoxyphenyl)-2,5-dioxo-3-pyrrolidinyl]sulfanyl}nicotinonitrile |
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/C21H21N3O3S/c1-13(2)10-15-5-4-14(12-22)20(23-15)28-18-11-19(25)24(21(18)26)16-6-8-17(27-3)9-7-16/h4-9,13,18H,10-11H2,1-3H3 |
InChIKey |
RXOZVAQMDRYKDI-UHFFFAOYSA-N |
NMR Offset |
14.9921 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Origin |
1H_UBI_21270_12733 |
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: UZI/9125004; UBI_ID: UBI-012736 |
Temperature |
313 °C |