| SpectraBase Spectrum ID |
A8NjvopOQrz |
| Name |
alanine, N-benzoyl-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 |
436.085775913 u |
| Formula |
C18H14F6N2O4 |
| InChI |
InChI=1S/C18H14F6N2O4/c1-29-15(28)16(17(19,20)21,26-14(27)11-5-3-2-4-6-11)25-12-7-9-13(10-8-12)30-18(22,23)24/h2-10,25H,1H3,(H,26,27) |
| InChIKey |
HXVMTVKDXDOWHQ-UHFFFAOYSA-N |
| Molecular Weight |
436.310 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_12210 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10260717; Lab Info: AU; Lab Number: AU-0000044 |
![alanine, N-benzoyl-3,3,3-trifluoro-2-[[4-(trifluoromethoxy)phenyl]amino]-, methyl ester](/api/spectrum/A8NjvopOQrz/structure.png?h=300&w=458 "alanine, N-benzoyl-3,3,3-trifluoro-2-[[4-(trifluoromethoxy)phenyl]amino]-, methyl ester")
