SpectraBase Spectrum ID |
LX7AUYOK2BI |
Name |
benzeneacetamide, 4-(1-[(2-chloro-6-fluorophenyl)methyl]-1,4-dihydro-2,4-dioxothieno[3,2-d]pyrimidin-3(2H)-yl)-N-phenyl- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
519.081968518 u |
Formula |
C27H19ClFN3O3S |
InChI |
InChI=1S/C27H19ClFN3O3S/c28-21-7-4-8-22(29)20(21)16-31-23-13-14-36-25(23)26(34)32(27(31)35)19-11-9-17(10-12-19)15-24(33)30-18-5-2-1-3-6-18/h1-14H,15-16H2,(H,30,33) |
InChIKey |
DLOZOCAGFAYQCR-UHFFFAOYSA-N |
Molecular Weight |
519.978 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2021_6444 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/13289648 |