| SpectraBase Spectrum ID |
APVZZjdFKhD |
| Name |
3,4-CTMP TFA derivative |
| Alternate Name(s) |
3,4-Dichloromethylphenidate TFA derivative
Methyl 2-(3,4-dichlorophenyl)-2-(1-(2,2,2-trifluoroacetyl)piperidin-2-yl)acetate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H16Cl2F3NO3 |
| InChI |
InChI=1S/C16H16Cl2F3NO3/c1-25-14(23)13(9-5-6-10(17)11(18)8-9)12-4-2-3-7-22(12)15(24)16(19,20)21/h5-6,8,12-13H,2-4,7H2,1H3 |
| InChIKey |
IFZYHYZRBGBGEG-UHFFFAOYSA-N |
| Molecular Weight |
398.209 g/mol |
| SMILES |
C(C(=O)N1CCCCC1C(c1cc(c(cc1)Cl)Cl)C(=O)OC)(F)(F)F |
| SPLASH |
splash10-001i-1900000000-5b7b2108776f494053e9 |
| Source of Spectrum |
SWG-33-4082-0 |
| Wiley ID |
1810733 |
