| SpectraBase Spectrum ID |
5Wv3D3iVx3o |
| Name |
3,4-Aminopyridine 2HFB |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
501.015820693 u |
| Formula |
C13H5F14N3O2 |
| InChI |
InChI=1S/C13H5F14N3O2/c14-8(15,10(18,19)12(22,23)24)6(31)29-4-1-2-28-3-5(4)30-7(32)9(16,17)11(20,21)13(25,26)27/h1-3H,(H,30,32)(H,28,29,31) |
| InChIKey |
REBUCEWSKZHMDD-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
501.180 g/mol |
| Nominal Mass |
501 u |
| Quality |
991 |
| Retention Index |
1555 |
| SMILES |
C(C(C(NC1=C(NC(C(C(C(F)(F)F)(F)F)(F)F)=O)C=CN=C1)=O)(F)F)(C(F)(F)F)(F)F |
| SPLASH |
splash10-014i-9600000000-0bf23092a6256c582668 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
2,2,3,3,4,4,4-heptafluoro-N-(3-((2,2,3,3,4,4,4-heptafluorobutanoyl)amino)pyridin-4-yl)butanamide |
| Technique |
GC/MS |
| Wiley ID |
DD2024_009924 |
