| SpectraBase Spectrum ID |
8JEUuko1X4i |
| Name |
Dopamine 2PFP |
| CAS Registry Number |
52118-49-7 |
| Classification |
Pharmaceutical drug derivative |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
445.037189400 u |
| Formula |
C14H9F10NO4 |
| InChI |
InChI=1S/C14H9F10NO4/c15-11(16,13(19,20)21)9(27)25-4-3-6-1-2-8(7(26)5-6)29-10(28)12(17,18)14(22,23)24/h1-2,5,26H,3-4H2,(H,25,27) |
| InChIKey |
LACDNYIQNMPXPM-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
445.213 g/mol |
| Nominal Mass |
445 u |
| Quality |
944 |
| Retention Index |
3221 |
| SMILES |
C(C(F)(F)F)(C(NCCC1=CC(=C(OC(C(C(F)(F)F)(F)F)=O)C=C1)O)=O)(F)F |
| SPLASH |
splash10-004i-1951800000-04a9f8ff040ac2ddd32c |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
2-hydroxy-4-(2-((2,2,3,3,3-pentafluoropropanoyl)amino)ethyl)phenyl 2,2,3,3,3-pentafluoropropanoate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_001240 |
