| SpectraBase Spectrum ID |
8bDZpiESLlM |
| Name |
(S)-(-)-N-(pentafluorobenzylcarbamoyl)-threo-methylphenidate |
| Alternate Name(s) |
(perfluorophenyl)methyl (S)-2-((S)-2-((S)-2-methoxy-2-oxo-1-phenylethyl)piperidine-1-carbonyl)pyrrolidine-1-carboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H27F5N2O5 |
| InChI |
InChI=1S/C27H27F5N2O5/c1-38-26(36)19(15-8-3-2-4-9-15)17-10-5-6-12-33(17)25(35)18-11-7-13-34(18)27(37)39-14-16-20(28)22(30)24(32)23(31)21(16)29/h2-4,8-9,17-19H,5-7,10-14H2,1H3/t17-,18-,19-/m0/s1 |
| InChIKey |
MIEZHQUQIFRGSK-FHWLQOOXSA-N |
| Literature Reference DOI |
10.1002/rcm.6146 |
| Molecular Weight |
554.514 g/mol |
| SMILES |
c1(F)c(F)c(F)c(F)c(COC(=O)N2[C@](C(=O)N3[C@@](CCCC3)([C@](c3ccccc3)(C(=O)OC)[H])[H])(CCC2)[H])c1F |
| SPLASH |
splash10-0f8c-4890100000-0c36359c85cb74b3a792 |
| Source of Spectrum |
RCM-26-595-Fig2,CpdB |
| Wiley ID |
1814888 |
