SpectraBase Spectrum ID |
HR9DCR6XGzc |
Name |
7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 6-[[2-[2-(4-bromophenoxy)ethoxy]phenyl]methylene]-5,6-dihydro-5-imino-2-(1-methylethyl)-, |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
512.051774723 u |
Formula |
C23H21BrN4O3S |
InChI |
InChI=1S/C23H21BrN4O3S/c1-14(2)22-27-28-20(25)18(21(29)26-23(28)32-22)13-15-5-3-4-6-19(15)31-12-11-30-17-9-7-16(24)8-10-17/h3-10,13-14,25H,11-12H2,1-2H3/b18-13-,25-20? |
InChIKey |
IYWSZZRNKDLBDK-IVTJCWFQSA-N |
Molecular Weight |
513.410 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_17078 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: ZI/10033784; Lab Info: CEP; Lab Number: CEP-6700642 |