| SpectraBase Spectrum ID |
42IH4QTK8v6 |
| Name |
6-(3-Bromophenyl)-9-[2-(trifluoromethyl)benzyl]-9H-purine |
| Appearance |
Colorless solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
432.019743891 u |
| Formula |
C19H12BrF3N4 |
| InChI |
InChI=1S/C19H12BrF3N4/c20-14-6-3-5-12(8-14)16-17-18(25-10-24-16)27(11-26-17)9-13-4-1-2-7-15(13)19(21,22)23/h1-8,10-11H,9H2 |
| InChIKey |
PQBPEYOHVYWYKG-UHFFFAOYSA-N |
| Instrument Name |
JEOL AccuTof |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201609014 |
| Molecular Weight |
433.232 g/mol |
| Quality |
214 |
| Reported Formula |
C19H12(79)BrFN4 |
| SMILES |
C=1(Br)C=C(C=CC1)C1=C2C(=NC=N1)N(C=N2)CC1=C(C=CC=C1)C(F)(F)F |
| SPLASH |
splash10-0a4i-5289500000-5ddc992b32c5567b5fa1 |
| Source of Spectrum |
ACI-56-SM14-2h (DOI: 10.1002/anie.201609014) |
| Wiley ID |
1892848 |
![6-(3-Bromophenyl)-9-[2-(trifluoromethyl)benzyl]-9H-purine](/api/spectrum/42IH4QTK8v6/structure.png?h=300&w=458 "6-(3-Bromophenyl)-9-[2-(trifluoromethyl)benzyl]-9H-purine")
