| SpectraBase Spectrum ID |
CCDBZQafbOr |
| Name |
6-(3-Bromophenyl)-9-(4-fluorobenzyl)-9H-purine |
| Appearance |
Colorless solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
382.022937565 u |
| Formula |
C18H12BrFN4 |
| InChI |
InChI=1S/C18H12BrFN4/c19-14-3-1-2-13(8-14)16-17-18(22-10-21-16)24(11-23-17)9-12-4-6-15(20)7-5-12/h1-8,10-11H,9H2 |
| InChIKey |
RGBCIHDUIJOXLL-UHFFFAOYSA-N |
| Instrument Name |
JEOL AccuTof |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201609014 |
| Molecular Weight |
383.224 g/mol |
| Quality |
189 |
| Reported Formula |
C18H12(79)BrFN4 |
| SMILES |
C=1(Br)C=C(C=CC1)C1=C2C(=NC=N1)N(C=N2)CC1=CC=C(C=C1)F |
| SPLASH |
splash10-0a59-3659000000-4f7a0be31196f1dc7c0c |
| Source of Spectrum |
ACI-56-SM12-2f (DOI: 10.1002/anie.201609014) |
| Wiley ID |
1892847 |
