SpectraBase Spectrum ID |
79x6CkVsCVI |
Name |
N(9)-pentafluorobenzyl-O(6)-[2-(pentafluorobenzyloxy)ethyl]purine |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C21H10F10N4O2 |
InChI |
InChI=1S/C21H10F10N4O2/c22-9-7(10(23)14(27)17(30)13(9)26)3-35-6-34-19-20(35)32-5-33-21(19)37-2-1-36-4-8-11(24)15(28)18(31)16(29)12(8)25/h5-6H,1-4H2 |
InChIKey |
QWGXHOZIOAWWMB-UHFFFAOYSA-N |
Molecular Weight |
540.321 g/mol |
SMILES |
c1(c(c(F)c(c(c1F)F)F)F)C[n]1c2c(c(OCCOCc3c(c(F)c(c(c3F)F)F)F)ncn2)nc1 |
SPLASH |
splash10-001i-0709020000-50148c56d9cc0e637355 |
Source of Spectrum |
KO-18-967-14 |
Synonyms |
6-[2'-(pentafluorobenzyloxy)ethoxy]-9-(pentafluorobenzyl)purine
9-(2,3,4,5,6-pentafluorobenzyl)-6-{2-[(2,3,4,5,6-pentafluorobenzyl)oxy]ethoxy}-9H-purine |
Wiley ID |
1404533 |