| SpectraBase Compound ID | BRmyqKiV8HC |
|---|---|
| InChI | InChI=1S/C17H22F3NO2/c1-12-8-7-9-13(2)21(12)15(22)16(23-3,17(18,19)20)14-10-5-4-6-11-14/h4-6,10-13H,7-9H2,1-3H3/t12-,13-,16+/m0/s1 |
| InChIKey | XEOCHTBBTKISDK-HEHGZKQESA-N |
| Mol Weight | 329.36 g/mol |
| Molecular Formula | C17H22F3NO2 |
| Exact Mass | 329.160263 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | IGIJWUu7StM |
|---|---|
| Name | (2S,6S)-2,6-Dimethylpiperidine-(R)-MTPA Amide |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C17H22F3NO2 |
| InChI | InChI=1S/C17H22F3NO2/c1-12-8-7-9-13(2)21(12)15(22)16(23-3,17(18,19)20)14-10-5-4-6-11-14/h4-6,10-13H,7-9H2,1-3H3/t12-,13-,16+/m0/s1 |
| InChIKey | XEOCHTBBTKISDK-HEHGZKQESA-N |
| Molecular Weight | 329.363 g/mol |
| SMILES | C([C@@](C(F)(F)F)(c1ccccc1)OC)(N1[C@](CCC[C@@]1(C)[H])(C)[H])=O |
| SPLASH | splash10-0006-5900000000-13df8de309138bf252da |
| Source of Spectrum | J-61-2063-11 |
| Synonyms | (1R)-1-{[(2S,6S)-2,6-dimethylpiperidinyl]carbonyl}-2,2,2-trifluoro-1-phenylethyl methyl ether (2S,6S)-2,6-dimethyl-1-[(2R)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl]piperidine (2R)-1-[(2S,6S)-2,6-dimethyl-1-piperidinyl]-3,3,3-trifluoro-2-methoxy-2-phenyl-1-propanone (2R)-1-[(2S,6S)-2,6-dimethylpiperidin-1-yl]-3,3,3-trifluoro-2-methoxy-2-phenylpropan-1-one (2R)-1-[(2S,6S)-2,6-dimethyl-1-piperidyl]-3,3,3-trifluoro-2-methoxy-2-phenyl-propan-1-one (2R)-1-[(2S,6S)-2,6-dimethylpiperidin-1-yl]-3,3,3-tris(fluoranyl)-2-methoxy-2-phenyl-propan-1-one |
| Wiley ID | 1327057 |