| SpectraBase Spectrum ID |
8I0RU9DHCVc |
| Name |
Citalopram-M (Nor) PFP |
| Classification |
Pharmaceutical drug metabolite derivative |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
456.127246804 u |
| Formula |
C22H18F6N2O2 |
| InChI |
InChI=1S/C22H18F6N2O2/c1-30(19(31)21(24,25)22(26,27)28)10-2-9-20(16-4-6-17(23)7-5-16)18-8-3-14(12-29)11-15(18)13-32-20/h3-8,11H,2,9-10,13H2,1H3 |
| InChIKey |
MSDYEUODBNPITP-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
456.388 g/mol |
| Nominal Mass |
456 u |
| Quality |
998 |
| Retention Index |
2587 |
| SMILES |
C1(C=2C(=CC(=CC2)C#N)CO1)(C=1C=CC(=CC1)F)CCCN(C(C(C(F)(F)F)(F)F)=O)C |
| SPLASH |
splash10-000i-1490000000-8f2b4364866992a99b99 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
N-(3-(5-cyano-1-(4-fluorophenyl)-1,3-dihydro-2-benzofuran-1-yl)propyl)-2,2,3,3,3-pentafluoro-N-methylpropanamide |
| Technique |
GC/MS |
| Wiley ID |
DD2024_011682 |
