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(E)/(Z)-9-{[2-(Benzyloxymethyl)cyclobutylidene]methyl}adenine
SpectraBase Compound ID 3uX82tOOTKF
InChI InChI=1S/C18H19N5O/c19-17-16-18(21-11-20-17)23(12-22-16)8-14-6-7-15(14)10-24-9-13-4-2-1-3-5-13/h1-5,8,11-12,15H,6-7,9-10H2,(H2,19,20,21)/b14-8+
InChIKey IKVGWTGWKIGZGJ-RIYZIHGNSA-N
Mol Weight 321.38 g/mol
Molecular Formula C18H19N5O
Exact Mass 321.15896 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID wopBPktwwE
Name (E)/(Z)-9-{[2-(Benzyloxymethyl)cyclobutylidene]methyl}adenine
Comments Less than 3 mono-isotopic peaks
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Formula C18H19N5O
InChI InChI=1S/C18H19N5O/c19-17-16-18(21-11-20-17)23(12-22-16)8-14-6-7-15(14)10-24-9-13-4-2-1-3-5-13/h1-5,8,11-12,15H,6-7,9-10H2,(H2,19,20,21)/b14-8+
InChIKey IKVGWTGWKIGZGJ-RIYZIHGNSA-N
Molecular Weight 321.384 g/mol
SMILES Nc1c2c([n](cn2)\C=C/2CCC2COCc2ccccc2)ncn1
SPLASH splash10-0006-9002000000-c5ed115af0ffaf4fc5eb
Source of Spectrum J-65-5183-35
Synonyms 9-((E)-{2-[(benzyloxy)methyl]cyclobutylidene}methyl)-9H-purin-6-amine 9-((E)-{2-[(benzyloxy)methyl]cyclobutylidene}methyl)-9H-purin-6-ylamine
Wiley ID 1533025