You must have made some mistake.
pH of buffers is not completely unaffected by dilution. Changes are minute, but they are there. After all, once you dilute the buffer infinitely you are left with just pure water, so naively you could expect on dilution the pH should drift to 7.00. But it should never go past 7.00 like you describe.
Actually DI water is never perfectly neutral, even just opening the bottle is enough for atmospheric CO2 to dissolve and change pH to slightly acidic. That makes predictions of changes in pH on dilution pretty hard, but 8.21 is definitely not something to be expected.