| SpectraBase Spectrum ID |
JwiNBkFQXHQ |
| Name |
N-[3-(N'-(1-Benzyloxycarbonyl-2-methylpropyl)amino-4,4,4-trifluoro-1-oxo-butyl)]-N-(1-methoxycarbonylethyl)amide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
432.187206461 u |
| Formula |
C20H27F3N2O5 |
| InChI |
InChI=1S/C20H27F3N2O5/c1-12(2)17(19(28)30-11-14-8-6-5-7-9-14)25-15(20(21,22)23)10-16(26)24-13(3)18(27)29-4/h5-9,12-13,15,17,25H,10-11H2,1-4H3,(H,24,26) |
| InChIKey |
UPUVZDIHWODPPT-UHFFFAOYSA-N |
| Molecular Weight |
432.440 g/mol |
| SMILES |
C(C(NC(C(OCC1=CC=CC=C1)=O)C(C)C)CC(NC(C(=O)OC)C)=O)(F)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.910926 |
![N-[3-(N'-(1-benzyloxycarbonyl-2-methylpropyl)amino-4,4,4-trifluoro-1-oxo-butyl)]-N-(1-methoxycarbonylethyl)amide](/api/spectrum/JwiNBkFQXHQ/structure.png?h=300&w=458 "N-[3-(N'-(1-benzyloxycarbonyl-2-methylpropyl)amino-4,4,4-trifluoro-1-oxo-butyl)]-N-(1-methoxycarbonylethyl)amide")
