SpectraBase Spectrum ID |
7OLn0a3kbM7 |
Name |
3-(2-Ethylhexoxy)propan-1-amine, N-trifluoroacetyl |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
283.175913504 u |
Formula |
C13H24F3NO2 |
InChI |
InChI=1S/C13H24F3NO2/c1-3-5-7-11(4-2)10-19-9-6-8-17-12(18)13(14,15)16/h11H,3-10H2,1-2H3,(H,17,18) |
InChIKey |
ICTVAXQPDDSLGE-UHFFFAOYSA-N |
Molecular Weight |
283.335 g/mol |
SMILES |
CCCCC(COCCCNC(C(F)(F)F)=O)CC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.90948 |