SpectraBase Spectrum ID |
DgkA64a6Zw5 |
Name |
2,4,6(1H,3H,5H)-pyrimidinetrione, 5-[[3-chloro-5-methoxy-4-[2-(2-methylphenoxy)ethoxy]phenyl]methylene]- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
430.093164034 u |
Formula |
C21H19ClN2O6 |
InChI |
InChI=1S/C21H19ClN2O6/c1-12-5-3-4-6-16(12)29-7-8-30-18-15(22)10-13(11-17(18)28-2)9-14-19(25)23-21(27)24-20(14)26/h3-6,9-11H,7-8H2,1-2H3,(H2,23,24,25,26,27) |
InChIKey |
YQHUQEWQYJOPAR-UHFFFAOYSA-N |
Molecular Weight |
430.844 g/mol |
NMR Offset |
18.0059 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_8272 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/9264387; Lab Info: CEP; Lab Number: CEP-9060083 |
Temperature |
29.85 °C |