SpectraBase Spectrum ID |
HVS8rhVyrub |
Name |
2-propenoic acid, 3-fluoro-3-[(2-oxopropyl)thio]-2-(trifluoromethyl)-,methyl ester, (2E)- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
260.013027941 u |
Formula |
C8H8F4O3S |
InChI |
InChI=1S/C8H8F4O3S/c1-4(13)3-16-6(9)5(7(14)15-2)8(10,11)12/h3H2,1-2H3/b6-5+ |
InChIKey |
IYEXWIVQMAABAA-AATRIKPKSA-N |
Molecular Weight |
260.203 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_15543 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: ZI/10039770; Lab Info: SIZ; Lab Number: SIZ-0417008 |