SpectraBase Spectrum ID |
CBWUefr3Fja |
Name |
6,7-diethoxy-3-{5-[4-(2-methoxyphenyl)-1-piperazinyl]-5-oxopentyl}-2-thioxo-2,3-dihydro-4(1H)-quinazolinone |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
540.240641444 u |
Formula |
C28H36N4O5S |
InChI |
InChI=1S/C28H36N4O5S/c1-4-36-24-18-20-21(19-25(24)37-5-2)29-28(38)32(27(20)34)13-9-8-12-26(33)31-16-14-30(15-17-31)22-10-6-7-11-23(22)35-3/h6-7,10-11,18-19H,4-5,8-9,12-17H2,1-3H3,(H,29,38) |
InChIKey |
PJHZEKDCLRVVLG-UHFFFAOYSA-N |
Molecular Weight |
540.679 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2020_3853 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/12308385 |