| SpectraBase Compound ID | K0FtIz2djh2 |
|---|---|
| InChI | InChI=1S/C22H26F3NO4/c1-14-11-19(29-4)16(13-18(14)28-3)12-15(2)26-20(27)21(30-5,22(23,24)25)17-9-7-6-8-10-17/h6-11,13,15H,12H2,1-5H3,(H,26,27)/t15?,21-/m0/s1/i12D,15D/t12?,15?,21- |
| InChIKey | POAFWOZVKUXAHD-FNSGZOSASA-N |
| Mol Weight | 427.46 g/mol |
| Molecular Formula | C22H242D2F3NO4 |
| Exact Mass | 427.193946 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 5f0KwTbL31b |
|---|---|
| Name | N-((S)-.alpha.-methoxy-.alpha.-(trifluoromethyl)phenylacetyl)-3-(2',5'-dimethoxy-4'-methylphenyl)-2-amino-2,3-dideuteropropane |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H24D2F3NO4 |
| InChI | InChI=1S/C22H26F3NO4/c1-14-11-19(29-4)16(13-18(14)28-3)12-15(2)26-20(27)21(30-5,22(23,24)25)17-9-7-6-8-10-17/h6-11,13,15H,12H2,1-5H3,(H,26,27)/t15?,21-/m0/s1/i12D,15D/t12?,15?,21- |
| InChIKey | POAFWOZVKUXAHD-FNSGZOSASA-N |
| Molecular Weight | 427.460 g/mol |
| SMILES | N(C([C@](C(F)(F)F)(c1ccccc1)OC)=O)C(C(c1c(cc(c(c1)OC)C)OC)[2D])(C)[2D] |
| SPLASH | splash10-000f-0900000000-ace7abde081f8f07f601 |
| Source of Spectrum | KO-5-35-166 |
| Wiley ID | 1379629 |