| SpectraBase Spectrum ID |
AvxUPy2Tr85 |
| Name |
alanine, N-(5-chloro-2-methoxyphenyl)-3,3,3-trifluoro-2-[[[[4-(trifluoromethoxy)phenyl]amino]carbonyl]amino]-, 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 |
515.068267300 u |
| Formula |
C19H16ClF6N3O5 |
| InChI |
InChI=1S/C19H16ClF6N3O5/c1-32-14-8-3-10(20)9-13(14)28-17(15(30)33-2,18(21,22)23)29-16(31)27-11-4-6-12(7-5-11)34-19(24,25)26/h3-9,28H,1-2H3,(H2,27,29,31) |
| InChIKey |
FETWTFSLDOIBAQ-UHFFFAOYSA-N |
| Molecular Weight |
515.796 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_18215 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/11260306; Lab Info: AU; Lab Number: AU-01050016 |
![alanine, N-(5-chloro-2-methoxyphenyl)-3,3,3-trifluoro-2-[[[[4-(trifluoromethoxy)phenyl]amino]carbonyl]amino]-, methyl ester](/api/spectrum/AvxUPy2Tr85/structure.png?h=300&w=458 "alanine, N-(5-chloro-2-methoxyphenyl)-3,3,3-trifluoro-2-[[[[4-(trifluoromethoxy)phenyl]amino]carbonyl]amino]-, methyl ester")
