SpectraBase Spectrum ID |
5P2In9fqVSM |
Name |
5H-[1]benzopyrano[2,3-d]pyrimidine, 4-[[2-(3,4-dihydro-1(2H)-quinolinyl)-2-oxoethyl]thio]-2-(4-methoxyphenyl)- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
495.161662848 u |
Formula |
C29H25N3O3S |
InChI |
InChI=1S/C29H25N3O3S/c1-34-22-14-12-20(13-15-22)27-30-28-23(17-21-8-3-5-11-25(21)35-28)29(31-27)36-18-26(33)32-16-6-9-19-7-2-4-10-24(19)32/h2-5,7-8,10-15H,6,9,16-18H2,1H3 |
InChIKey |
QMZRBAISMZSZCR-UHFFFAOYSA-N |
Molecular Weight |
495.597 g/mol |
NMR Offset |
17.9973 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2021_8035 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/13309012 |