SpectraBase Spectrum ID |
Jk5YCVMnz8o |
Name |
2-[1-(4-chloro-2,5-difluorobenzoyl)-4-piperidinyl]-8,9-dimethoxy[1,2,4]triazolo[1,5-c]quinazoline-5(6H)-thione |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
519.094344721 u |
Formula |
C23H20ClF2N5O3S |
InChI |
InChI=1S/C23H20ClF2N5O3S/c1-33-18-8-13-17(10-19(18)34-2)27-23(35)31-21(13)28-20(29-31)11-3-5-30(6-4-11)22(32)12-7-16(26)14(24)9-15(12)25/h7-11H,3-6H2,1-2H3,(H,27,35) |
InChIKey |
KDCFHZRUGRFWDN-UHFFFAOYSA-N |
Molecular Weight |
519.955 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2020_6978 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/12329436 |