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9-(3-Bromophenyl)-2,6-bis(trifluoromethyl)-9H-purine
SpectraBase Compound ID Ei6xSmCbc1c
InChI InChI=1S/C13H5BrF6N4/c14-6-2-1-3-7(4-6)24-5-21-8-9(12(15,16)17)22-11(13(18,19)20)23-10(8)24/h1-5H
InChIKey QBBUZZDCXGSMFZ-UHFFFAOYSA-N
Mol Weight 411.11 g/mol
Molecular Formula C13H5BrF6N4
Exact Mass 409.960178 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LGF9SRp3dys
Name 9-(3-Bromophenyl)-2,6-bis(trifluoromethyl)-9H-purine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H5BrF6N4
InChI InChI=1S/C13H5BrF6N4/c14-6-2-1-3-7(4-6)24-5-21-8-9(12(15,16)17)22-11(13(18,19)20)23-10(8)24/h1-5H
InChIKey QBBUZZDCXGSMFZ-UHFFFAOYSA-N
Molecular Weight 411.105 g/mol
SMILES c12c(c(C(F)(F)F)nc(n2)C(F)(F)F)nc[n]1-c1cc(Br)ccc1
SPLASH splash10-03di-0000900000-a95af82fef36e755c65c
Source of Spectrum F-67-8328-10h
Wiley ID 1690947