| SpectraBase Spectrum ID |
4Yu62zbMJc |
| Name |
Pimozide |
| CAS Registry Number |
2062-78-4 |
| Classification |
Neuroleptic |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
461.227868891 u |
| Formula |
C28H29F2N3O |
| InChI |
InChI=1S/C28H29F2N3O/c29-22-11-7-20(8-12-22)25(21-9-13-23(30)14-10-21)4-3-17-32-18-15-24(16-19-32)33-27-6-2-1-5-26(27)31-28(33)34/h1-2,5-14,24-25H,3-4,15-19H2,(H,31,34) |
| InChIKey |
YVUQSNJEYSNKRX-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
461.557 g/mol |
| SMILES |
c1cc(C(CCCN2CCC(N3C(=O)Nc4c3cccc4)CC2)c2ccc(cc2)F)ccc1F |
| SPLASH |
splash10-001i-8790200000-ac0dd7c1eec8d44715ce |
| 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 |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_596 |
