SpectraBase Spectrum ID |
LaZOLP9q6d3 |
Name |
benzamide, N-[(1Z)-3-(2-chlorophenyl)-1-[[2-[(3-chlorophenyl)amino]-2-oxoethyl]thio]-2-cyano-5-oxo-5-phenyl-1-pentenyl]- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
613.099368248 u |
Formula |
C33H25Cl2N3O3S |
InChI |
InChI=1S/C33H25Cl2N3O3S/c34-24-14-9-15-25(18-24)37-31(40)21-42-33(38-32(41)23-12-5-2-6-13-23)28(20-36)27(26-16-7-8-17-29(26)35)19-30(39)22-10-3-1-4-11-22/h1-18,27H,19,21H2,(H,37,40)(H,38,41)/b33-28+ |
InChIKey |
JARDOCYNTMQYJZ-PJJLUWSFSA-N |
Molecular Weight |
614.547 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_10564 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10251861; Lab Info: KR; Lab Number: KR-KV00249 |