| SpectraBase Spectrum ID |
88SMvj2feBx |
| Name |
3-(2-Chlorophenyl)-N-[1-(3-methoxyphenyl)ethyl]propan-1-amine, N-trifluoroacetyl- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
399.121291107 u |
| Formula |
C20H21ClF3NO2 |
| InChI |
InChI=1S/C20H21ClF3NO2/c1-14(16-8-5-10-17(13-16)27-2)25(19(26)20(22,23)24)12-6-9-15-7-3-4-11-18(15)21/h3-5,7-8,10-11,13-14H,6,9,12H2,1-2H3 |
| InChIKey |
JXAFMQWRBBEGFQ-UHFFFAOYSA-N |
| Molecular Weight |
399.841 g/mol |
| SMILES |
C1(Cl)=C(C=CC=C1)CCCN(C(C)C1=CC(=CC=C1)OC)C(C(F)(F)F)=O |
![3-(2-Chlorophenyl)-N-[1-(3-methoxyphenyl)ethyl]propan-1-amine, N-trifluoroacetyl-](/api/spectrum/88SMvj2feBx/structure.png?h=300&w=458 "3-(2-Chlorophenyl)-N-[1-(3-methoxyphenyl)ethyl]propan-1-amine, N-trifluoroacetyl-")
