SpectraBase Spectrum ID |
LPz7UVx3sQO |
Name |
propanoic acid, 3-[[2-[4-(difluoromethoxy)phenyl]-2-oxoethyl]thio]- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
290.042436362 u |
Formula |
C12H12F2O4S |
InChI |
InChI=1S/C12H12F2O4S/c13-12(14)18-9-3-1-8(2-4-9)10(15)7-19-6-5-11(16)17/h1-4,12H,5-7H2,(H,16,17) |
InChIKey |
QAFUSUGBNWUMPV-UHFFFAOYSA-N |
Molecular Weight |
290.281 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_16226 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10321195; Lab Info: DEM; Lab Number: DEM-0000343 |