| SpectraBase Spectrum ID |
DFPwx59XJy3 |
| Name |
(+/-)-threo-4-Fluoromethylphenidate hydrochloride |
| Source of Sample |
Cayman Chemical Company |
| Catalog Number |
9002651 |
| Lot Number |
0480761-8 |
| Cell Type |
Capillary tube |
| Compound Type |
Pure |
| Copyright |
Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H19ClFNO2 |
| IUPAC Name |
(αR,2R)-rel-α-(4-Fluorophenyl)-2-piperidineacetic acid, methyl ester, monohydrochloride |
| InChI |
InChI=1S/C14H18FNO2.ClH/c1-18-14(17)13(12-4-2-3-9-16-12)10-5-7-11(15)8-6-10;/h5-8,12-13,16H,2-4,9H2,1H3;1H/t12-,13-;/s2 |
| InChIKey |
NCCJEXAXCWALQG-XAPIXSTRSA-N |
| Raman Corrections |
Referenced to internal white light source; 180 degree backscatter |
| Raman Laser Power |
649 mW |
| Raman Laser Source |
Nd:YAG |
| SMILES |
N1CCCC[C@@]1([C@@](c1ccc(cc1)F)(C(OC)=O)[H])[H].Cl |
| Scans Performed |
5568 |
| Source of Spectrum |
Forensic Spectral Research |
| Technique |
FT-Raman |
