SpectraBase Spectrum ID |
6VhwWXW5Kle |
Name |
acetamide, N-(2-benzoyl-4-chlorophenyl)-2-[[3-cyano-6-phenyl-4-(trifluoromethyl)-2-pyridinyl]thio]- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
551.068210160 u |
Formula |
C28H17ClF3N3O2S |
InChI |
InChI=1S/C28H17ClF3N3O2S/c29-19-11-12-23(20(13-19)26(37)18-9-5-2-6-10-18)34-25(36)16-38-27-21(15-33)22(28(30,31)32)14-24(35-27)17-7-3-1-4-8-17/h1-14H,16H2,(H,34,36) |
InChIKey |
XIQQWIRAAORZND-UHFFFAOYSA-N |
Molecular Weight |
551.971 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_11532 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10261619; Lab Info: NKS; Lab Number: NKS-ACA0293 |