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(E)-9-BENZYL-6-[2-(DIBUTYLAMINO)-VINYL]-PURINE
SpectraBase Compound ID EXOknMY8SwK
InChI InChI=1S/C22H29N5/c1-3-5-13-26(14-6-4-2)15-12-20-21-22(24-17-23-20)27(18-25-21)16-19-10-8-7-9-11-19/h7-12,15,17-18H,3-6,13-14,16H2,1-2H3/b15-12+
InChIKey MPUXIRVYHOVMFY-NTCAYCPXSA-N
Mol Weight 363.51 g/mol
Molecular Formula C22H29N5
Exact Mass 363.242296 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JMnYcQdVIgs
Name N-butyl-N-[(E)-2-[9-(phenylmethyl)-6-purinyl]ethenyl]-1-butanamine
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Formula C22H29N5
InChI InChI=1S/C22H29N5/c1-3-5-13-26(14-6-4-2)15-12-20-21-22(24-17-23-20)27(18-25-21)16-19-10-8-7-9-11-19/h7-12,15,17-18H,3-6,13-14,16H2,1-2H3/b15-12+
InChIKey MPUXIRVYHOVMFY-NTCAYCPXSA-N
Molecular Weight 363.509 g/mol
SMILES c1nc2c(ncnc2[n]1Cc1ccccc1)\C=C\N(CCCC)CCCC
SPLASH splash10-03ed-3549000000-fca59a9165d9801cfa0b
Source of Spectrum K1-0-5090-9
Synonyms N-butyl-N-[(E)-2-[9-(phenylmethyl)purin-6-yl]ethenyl]butan-1-amine N-[(E)-2-(9-benzylpurin-6-yl)ethenyl]-N-butylbutan-1-amine N-[(E)-2-(9-benzylpurin-6-yl)vinyl]-N-butyl-butan-1-amine [(E)-2-(9-benzylpurin-6-yl)vinyl]-dibutyl-amine
Wiley ID 1589787