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9-butyl-6-(4-(4-propoxyphenyl)piperazin-1-yl)-9H-purine
SpectraBase Compound ID FUAHXB4XIAh
InChI InChI=1S/C22H30N6O/c1-3-5-10-28-17-25-20-21(23-16-24-22(20)28)27-13-11-26(12-14-27)18-6-8-19(9-7-18)29-15-4-2/h6-9,16-17H,3-5,10-15H2,1-2H3
InChIKey FCBUMGQMAVGOTG-UHFFFAOYSA-N
Mol Weight 394.52 g/mol
Molecular Formula C22H30N6O
Exact Mass 394.24811 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LaCzYTMxqab
Name 9-butyl-6-(4-(4-propoxyphenyl)piperazin-1-yl)-9H-purine
Appearance Colorless solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H30N6O
InChI InChI=1S/C22H30N6O/c1-3-5-10-28-17-25-20-21(23-16-24-22(20)28)27-13-11-26(12-14-27)18-6-8-19(9-7-18)29-15-4-2/h6-9,16-17H,3-5,10-15H2,1-2H3
InChIKey FCBUMGQMAVGOTG-UHFFFAOYSA-N
Instrument Name SHIMADZU QP2010S
Ionization Type EI
Literature Reference DOI 10.1002/cbdv.202000053
Molecular Weight 394.523 g/mol
SMILES c1(ncnc2c1nc[n]2CCCC)N1CCN(CC1)c1ccc(cc1)OCCC
SPLASH splash10-0udl-4961000000-e5b68e332998bc4a1c73
Source of Spectrum CBD-17-SM15-PPC04
Wiley ID 1855948