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9-tert-Butyl-2,6-bis(trifluoromethyl)-9H-purine

View entire compound with spectra: 1 MS (GC)

9-tert-Butyl-2,6-bis(trifluoromethyl)-9H-purine
SpectraBase Compound ID 5fCaTnVPhod
InChI InChI=1S/C11H10F6N4/c1-9(2,3)21-4-18-5-6(10(12,13)14)19-8(11(15,16)17)20-7(5)21/h4H,1-3H3
InChIKey YBRPAOCRTOJDAU-UHFFFAOYSA-N
Mol Weight 312.22 g/mol
Molecular Formula C11H10F6N4
Exact Mass 312.080965 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ij2xlSks4AH
Name 9-tert-Butyl-2,6-bis(trifluoromethyl)-9H-purine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H10F6N4
InChI InChI=1S/C11H10F6N4/c1-9(2,3)21-4-18-5-6(10(12,13)14)19-8(11(15,16)17)20-7(5)21/h4H,1-3H3
InChIKey YBRPAOCRTOJDAU-UHFFFAOYSA-N
Molecular Weight 312.219 g/mol
SMILES c12c(c(C(F)(F)F)nc(n2)C(F)(F)F)nc[n]1C(C)(C)C
SPLASH splash10-0a4i-6092000000-8bdb577414a4ef92a06e
Source of Spectrum F-67-8325-9a
Wiley ID 1690966