SpectraBase Spectrum ID |
9l2n68vvIVT |
Name |
acetamide, 2-[[3-cyano-6-phenyl-4-(trifluoromethyl)-2-pyridinyl]thio]-N-[4-(1H-pyrrol-1-yl)-1,2,5-oxadiazol-3-yl]- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
470.077279344 u |
Formula |
C21H13F3N6O2S |
InChI |
InChI=1S/C21H13F3N6O2S/c22-21(23,24)15-10-16(13-6-2-1-3-7-13)26-20(14(15)11-25)33-12-17(31)27-18-19(29-32-28-18)30-8-4-5-9-30/h1-10H,12H2,(H,27,28,31) |
InChIKey |
GUQQIXBMDBQACQ-UHFFFAOYSA-N |
Molecular Weight |
470.430 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2021_9121 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/13291894; Lab Info: SMM; Lab Number: SMM-0000018 |