| SpectraBase Spectrum ID |
G8XiGEUKpwc |
| Name |
Ritalinic acid-D9 isomer-2 HFB PFP @ |
| Classification |
Stimulant |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
556.158172078 u |
| Formula |
C20H8D9F12NO3 |
| InChI |
InChI=1S/C20H17F12NO3/c21-16(22,19(27,28)29)10-36-14(34)13(11-6-2-1-3-7-11)12-8-4-5-9-33(12)15(35)17(23,24)18(25,26)20(30,31)32/h1-3,6-7,12-13H,4-5,8-10H2/i4D2,5D2,8D2,9D2,12D |
| InChIKey |
DXPYCCSLUKNZGT-VRKVKMQMSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
556.396 g/mol |
| SMILES |
C1(C(C(C(C(OCC(F)(F)C(F)(F)F)=O)c2ccccc2)(N(C(C(F)(F)C(F)(F)C(F)(F)F)=O)C([D])(C1([D])[D])[D])[D])([D])[D])([D])[D] |
| SPLASH |
splash10-000i-3290000000-b15aeae6f2330c772f99 |
| Sample Comments |
The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database. |
| Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
| Synonyms |
Ethylphenidate-M (ritalinic acid)-D9 isomer-2 HFB PFPOL
Methylphenidate-M (ritalinic acid)-D9 isomer-2 HFB PFPOL
Ritalinic acid-D9 isomer-2 HFB PFPOL |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_9349 |
