SpectraBase Spectrum ID |
8MhC8fEKpxj |
Name |
2-(benzylsulfanyl)-3-(3-bromophenyl)-6,6-dimethyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
512.022783270 u |
Formula |
C24H21BrN2O2S2 |
InChI |
InChI=1S/C24H21BrN2O2S2/c1-24(2)12-18-19(13-29-24)31-21-20(18)22(28)27(17-10-6-9-16(25)11-17)23(26-21)30-14-15-7-4-3-5-8-15/h3-11H,12-14H2,1-2H3 |
InChIKey |
UYCBLOYNGRRRFP-UHFFFAOYSA-N |
Molecular Weight |
513.468 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2020_2037 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/12278806 |