| SpectraBase Spectrum ID |
9PJFSIBNkpC |
| Name |
butanoic acid, 2-acetyl-4,4,4-trifluoro-3-[(3-pyridinylcarbonyl)amino]-3-(trifluoromethyl)-, 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 |
400.085775913 u |
| Formula |
C15H14F6N2O4 |
| InChI |
InChI=1S/C15H14F6N2O4/c1-3-27-12(26)10(8(2)24)13(14(16,17)18,15(19,20)21)23-11(25)9-5-4-6-22-7-9/h4-7,10H,3H2,1-2H3,(H,23,25) |
| InChIKey |
MVRKKFNBRPIEIB-UHFFFAOYSA-N |
| Molecular Weight |
400.277 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_7361 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10230082; Lab Info: AU; Lab Number: AU-T000906 |
| Temperature |
29.85 °C |
