| SpectraBase Spectrum ID |
IoSeGMXRIer |
| Name |
3-thiophenecarboxylic acid, 5-ethyl-4-phenyl-2-[[3,3,3-trifluoro-1-oxo-2-(trifluoromethyl)propyl]amino]-, ethyl ester |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
453.083333560 u |
| Formula |
C19H17F6NO3S |
| InChI |
InChI=1S/C19H17F6NO3S/c1-3-11-12(10-8-6-5-7-9-10)13(17(28)29-4-2)16(30-11)26-15(27)14(18(20,21)22)19(23,24)25/h5-9,14H,3-4H2,1-2H3,(H,26,27) |
| InChIKey |
JSQMEXIMQDZJCD-UHFFFAOYSA-N |
| Molecular Weight |
453.399 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_17157 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10320509; Lab Info: DYA; Lab Number: DYA-0101022 |
![3-thiophenecarboxylic acid, 5-ethyl-4-phenyl-2-[[3,3,3-trifluoro-1-oxo-2-(trifluoromethyl)propyl]amino]-, ethyl ester](/api/spectrum/IoSeGMXRIer/structure.png?h=300&w=458 "3-thiophenecarboxylic acid, 5-ethyl-4-phenyl-2-[[3,3,3-trifluoro-1-oxo-2-(trifluoromethyl)propyl]amino]-, ethyl ester")
