| SpectraBase Spectrum ID |
2RlBfHhRfXQ |
| Name |
alanine, N-(2-chlorobenzoyl)-3,3,3-trifluoro-2-[[4-(trifluoromethoxy)phenyl]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 |
470.046803581 u |
| Formula |
C18H13ClF6N2O4 |
| InChI |
InChI=1S/C18H13ClF6N2O4/c1-30-15(29)16(17(20,21)22,27-14(28)12-4-2-3-5-13(12)19)26-10-6-8-11(9-7-10)31-18(23,24)25/h2-9,26H,1H3,(H,27,28) |
| InChIKey |
WLORRNDRJMHILK-UHFFFAOYSA-N |
| Molecular Weight |
470.755 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_12212 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10260722; Lab Info: AU; Lab Number: AU-0000049 |
![alanine, N-(2-chlorobenzoyl)-3,3,3-trifluoro-2-[[4-(trifluoromethoxy)phenyl]amino]-, methyl ester](/api/spectrum/2RlBfHhRfXQ/structure.png?h=300&w=458 "alanine, N-(2-chlorobenzoyl)-3,3,3-trifluoro-2-[[4-(trifluoromethoxy)phenyl]amino]-, methyl ester")
