| SpectraBase Compound ID | KXhpwJIJ8TN |
|---|---|
| InChI | InChI=1S/C25H24F3NO2S/c1-29-24(30)21-11-5-6-12-23(21)32(31)22(13-7-10-18-8-3-2-4-9-18)19-14-16-20(17-15-19)25(26,27)28/h2-6,8-9,11-12,14-17,22H,7,10,13H2,1H3,(H,29,30)/t22-,32?/m1/s1 |
| InChIKey | GMWPAVBFZKRBDN-GFTAOQHMSA-N |
| Mol Weight | 459.53 g/mol |
| Molecular Formula | C25H24F3NO2S |
| Exact Mass | 459.147985 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 8nJBZtbrKbR |
|---|---|
| Name | N-Methyl-2-(4-phenyl-1-(4-(trifluoromethyl)phenyl)butylsulfinyl)benzamide |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C25H24F3NO2S |
| InChI | InChI=1S/C25H24F3NO2S/c1-29-24(30)21-11-5-6-12-23(21)32(31)22(13-7-10-18-8-3-2-4-9-18)19-14-16-20(17-15-19)25(26,27)28/h2-6,8-9,11-12,14-17,22H,7,10,13H2,1H3,(H,29,30)/t22-,32?/m1/s1 |
| InChIKey | GMWPAVBFZKRBDN-GFTAOQHMSA-N |
| Molecular Weight | 459.527 g/mol |
| SMILES | N(C(c1c(S([C@@](c2ccc(C(F)(F)F)cc2)(CCCc2ccccc2)[H])=O)cccc1)=O)C |
| SPLASH | splash10-0fr6-6920000000-78dfc1c24b0919e4a7f9 |
| Source of Spectrum | F-67-5278-2k |
| Synonyms | N-Methyl-2-[(R)-4-phenyl-1-(4-trifluoromethyl-phenyl)-butane-1-sulfinyl]-benzamide |
| Wiley ID | 1686910 |