SpectraBase Spectrum ID |
HKdqSgNHwTb |
Name |
5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid, 5-(4-chlorophenyl)-2-[(3-ethoxy-4-hydroxy-5-iodophenyl)methylene]-2,3-dihydro-7-methyl-3-oxo-, ethyl |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
623.998265685 u |
Formula |
C25H22ClIN2O5S |
InChI |
InChI=1S/C25H22ClIN2O5S/c1-4-33-18-11-14(10-17(27)22(18)30)12-19-23(31)29-21(15-6-8-16(26)9-7-15)20(24(32)34-5-2)13(3)28-25(29)35-19/h6-12,21,30H,4-5H2,1-3H3/b19-12+ |
InChIKey |
NNRUTYNQKUQNMO-XDHOZWIPSA-N |
Molecular Weight |
624.877 g/mol |
NMR Offset |
18.0059 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_471 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: ZI/8027559; Lab Info: LD; Lab Number: LD-1300139 |
Temperature |
29.85 °C |