SpectraBase Spectrum ID |
K3kVn3wnxyQ |
Name |
5-(hydroxymethyl)-8-methyl-3-[5-(4-phenoxyanilino)-1,3,4-thiadiazol-2-yl]-2H-pyrano[2,3-c]pyridin-2-one |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
458.104876246 u |
Formula |
C24H18N4O4S |
InChI |
InChI=1S/C24H18N4O4S/c1-14-21-19(15(13-29)12-25-14)11-20(23(30)32-21)22-27-28-24(33-22)26-16-7-9-18(10-8-16)31-17-5-3-2-4-6-17/h2-12,29H,13H2,1H3,(H,26,28) |
InChIKey |
IPEKGMQYZGGJTN-UHFFFAOYSA-N |
Molecular Weight |
458.492 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2020_5358 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/12319012 |