| SpectraBase Spectrum ID |
Dn4IP4ZKqhJ |
| Name |
propanoic acid, 3,3,3-trifluoro-2-(5-methyl-1,3-benzoxathiol-2-ylidene)-, 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 |
290.022449810 u |
| Formula |
C12H9F3O3S |
| InChI |
InChI=1S/C12H9F3O3S/c1-6-3-4-7-8(5-6)19-11(18-7)9(10(16)17-2)12(13,14)15/h3-5H,1-2H3/b11-9+ |
| InChIKey |
OVTHURJGJPIRKW-PKNBQFBNSA-N |
| Molecular Weight |
290.256 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_15533 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: ZI/10039296; Lab Info: SIZ; Lab Number: SIZ-0417017 |
