| SpectraBase Spectrum ID |
Ja0wPBsHUny |
| Name |
alanine, N-(3-cyano-4-ethyl-5-methyl-2-thienyl)-3,3,3-trifluoro-2-[(1-oxopropyl)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 |
391.117747176 u |
| Formula |
C16H20F3N3O3S |
| InChI |
InChI=1S/C16H20F3N3O3S/c1-5-10-9(4)26-13(11(10)8-20)22-15(16(17,18)19,14(24)25-7-3)21-12(23)6-2/h22H,5-7H2,1-4H3,(H,21,23) |
| InChIKey |
FRLBXXPJYRHVER-UHFFFAOYSA-N |
| Molecular Weight |
391.409 g/mol |
| NMR Offset |
17.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_5603 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/9290892; Lab Info: AU; Lab Number: AU-EC00504 |
![alanine, N-(3-cyano-4-ethyl-5-methyl-2-thienyl)-3,3,3-trifluoro-2-[(1-oxopropyl)amino]-, ethyl ester](/api/spectrum/Ja0wPBsHUny/structure.png?h=300&w=458 "alanine, N-(3-cyano-4-ethyl-5-methyl-2-thienyl)-3,3,3-trifluoro-2-[(1-oxopropyl)amino]-, ethyl ester")
