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9-Benzyl-6-[3-(phenoxy)propa-1,2-dien-1-yl]-9H-purine
SpectraBase Compound ID BWJILUlgs5a
InChI InChI=1S/C21H16N4O/c1-3-8-17(9-4-1)14-25-16-24-20-19(22-15-23-21(20)25)12-7-13-26-18-10-5-2-6-11-18/h1-6,8-13,15-16H,14H2
InChIKey WFQQWKADUSWEHI-UHFFFAOYSA-N
Mol Weight 340.39 g/mol
Molecular Formula C21H16N4O
Exact Mass 340.132411 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G7fRYNfXu3h
Name 9-Benzyl-6-[3-(phenoxy)propa-1,2-dien-1-yl]-9H-purine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H16N4O
InChI InChI=1S/C21H16N4O/c1-3-8-17(9-4-1)14-25-16-24-20-19(22-15-23-21(20)25)12-7-13-26-18-10-5-2-6-11-18/h1-6,8-13,15-16H,14H2
InChIKey WFQQWKADUSWEHI-UHFFFAOYSA-N
Molecular Weight 340.386 g/mol
SMILES c1nc2c(ncnc2[n]1Cc1ccccc1)C=C=COc1ccccc1
SPLASH splash10-0006-7039000000-510aa59f202d219f1db3
Source of Spectrum F-62-6129-10
Synonyms 3-(9-benzyl-9H-purin-6-yl)-1,2-propadienyl phenyl ether 9-Benzyl-6-(3-phenoxy-1,2-propadienyl)-9H-purine
Wiley ID 1633898