SpectraBase Spectrum ID |
LAuXq2j5kww |
Name |
acetamide, N-[3,5-bis(trifluoromethyl)phenyl]-2-[[3-cyano-6-(2-thienyl)-4-(trifluoromethyl)-2-pyridinyl]thio]- |
Copyright |
Copyright © 2022-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
555.012157768 u |
Formula |
C21H10F9N3OS2 |
InChI |
InChI=1S/C21H10F9N3OS2/c22-19(23,24)10-4-11(20(25,26)27)6-12(5-10)32-17(34)9-36-18-13(8-31)14(21(28,29)30)7-15(33-18)16-2-1-3-35-16/h1-7H,9H2,(H,32,34) |
InChIKey |
BPKYDISWELDUFU-UHFFFAOYSA-N |
Molecular Weight |
555.437 g/mol |
NMR Offset |
18.0059 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_11529 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10261616; Lab Info: NKS; Lab Number: NKS-ACA0289 |
Temperature |
23.85 °C |