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9-Cyclohexyl-2,6-bis(trifluoromethyl)-9H-purine
SpectraBase Compound ID 2GU8RIm7jFl
InChI InChI=1S/C13H12F6N4/c14-12(15,16)9-8-10(22-11(21-9)13(17,18)19)23(6-20-8)7-4-2-1-3-5-7/h6-7H,1-5H2
InChIKey PEWPHFVZDSIYKI-UHFFFAOYSA-N
Mol Weight 338.26 g/mol
Molecular Formula C13H12F6N4
Exact Mass 338.096615 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1JXoLau66aG
Name 9-Cyclohexyl-2,6-bis(trifluoromethyl)-9H-purine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12F6N4
InChI InChI=1S/C13H12F6N4/c14-12(15,16)9-8-10(22-11(21-9)13(17,18)19)23(6-20-8)7-4-2-1-3-5-7/h6-7H,1-5H2
InChIKey PEWPHFVZDSIYKI-UHFFFAOYSA-N
Molecular Weight 338.257 g/mol
SMILES c12c(c(C(F)(F)F)nc(n2)C(F)(F)F)nc[n]1C1CCCCC1
SPLASH splash10-0a4r-2092000000-d258eea0d12e51f7c851
Source of Spectrum F-67-8325-9e
Wiley ID 1690962