| SpectraBase Spectrum ID |
J97csVS2UuE |
| Name |
N-[1-[(Adamantan-1-ylmethyl)-amino]-2,2,2-trifluoro-1-trifluoromethyl-ethyl]-2-phenyl-acetamide |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
448.194932442 u |
| Formula |
C22H26F6N2O |
| InChI |
InChI=1S/C22H26F6N2O/c23-21(24,25)20(22(26,27)28,30-18(31)9-14-4-2-1-3-5-14)29-13-19-10-15-6-16(11-19)8-17(7-15)12-19/h1-5,15-17,29H,6-13H2,(H,30,31)/t15-,16+,17-,19- |
| InChIKey |
KSONMXFBZCVYRV-SXOLKLDHSA-N |
| Molecular Weight |
448.453 g/mol |
| SMILES |
C(C(F)(F)F)(C(F)(F)F)(NC(=O)CC1=CC=CC=C1)NCC12C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H] |
![benzeneacetamide, N-[2,2,2-trifluoro-1-[(tricyclo[3.3.1.1~3,7~]dec-1-ylmethyl)amino]-1-(trifluoromethyl)ethyl]-](/api/spectrum/J97csVS2UuE/structure.png?h=300&w=458 "benzeneacetamide, N-[2,2,2-trifluoro-1-[(tricyclo[3.3.1.1~3,7~]dec-1-ylmethyl)amino]-1-(trifluoromethyl)ethyl]-")
