| SpectraBase Spectrum ID |
GYj53Rtk328 |
| Name |
3-thiophenecarboxylic acid, 2-[[1-(ethoxycarbonyl)-2,2,2-trifluoro-1-[(1-oxopentyl)amino]ethyl]amino]-4-ethyl-5-methyl-, methyl 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 |
452.159277635 u |
| Formula |
C19H27F3N2O5S |
| InChI |
InChI=1S/C19H27F3N2O5S/c1-6-9-10-13(25)23-18(19(20,21)22,17(27)29-8-3)24-15-14(16(26)28-5)12(7-2)11(4)30-15/h24H,6-10H2,1-5H3,(H,23,25) |
| InChIKey |
TWVYFELXQPCVIW-UHFFFAOYSA-N |
| Molecular Weight |
452.489 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_11472 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10261454; Lab Info: AU; Lab Number: AU-ES01058 |
![2-[[1-carbethoxy-2,2,2-trifluoro-1-(valerylamino)ethyl]amino]-4-ethyl-5-methyl-thiophene-3-carboxylic acid methyl ester](/api/spectrum/GYj53Rtk328/structure.png?h=300&w=458 "2-[[1-carbethoxy-2,2,2-trifluoro-1-(valerylamino)ethyl]amino]-4-ethyl-5-methyl-thiophene-3-carboxylic acid methyl ester")
