SpectraBase Spectrum ID |
36QXAEmESYM |
Name |
acetamide, N-[(2E,5E)-5-[[1-[(2-chloro-4-fluorophenyl)methyl]-1H-indol-3-yl]methylene]-4-oxothiazolidinylidene]- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
427.055753770 u |
Formula |
C21H15ClFN3O2S |
InChI |
InChI=1S/C21H15ClFN3O2S/c1-12(27)24-21-25-20(28)19(29-21)8-14-11-26(18-5-3-2-4-16(14)18)10-13-6-7-15(23)9-17(13)22/h2-9,11H,10H2,1H3,(H,24,25,27,28)/b19-8+ |
InChIKey |
OHAPAJRYHRWMNG-UFWORHAWSA-N |
Molecular Weight |
427.881 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_15106 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10311057; Lab Info: SAD; Lab Number: SAD-002533 |