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6-(6-phenyl-1,3-dihydroisobenzofuran-5-yl)-9-tetrahydropyran-2-yl-purine
SpectraBase Compound ID FuIRoRkMZss
InChI InChI=1S/C24H22N4O2/c1-2-6-16(7-3-1)19-10-17-12-29-13-18(17)11-20(19)22-23-24(26-14-25-22)28(15-27-23)21-8-4-5-9-30-21/h1-3,6-7,10-11,14-15,21H,4-5,8-9,12-13H2
InChIKey WFPHEDVFRLEIDA-UHFFFAOYSA-N
Mol Weight 398.47 g/mol
Molecular Formula C24H22N4O2
Exact Mass 398.174276 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BDkepHKT7Tx
Name 6-(6-phenyl-1,3-dihydroisobenzofuran-5-yl)-9-tetrahydropyran-2-yl-purine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H22N4O2
InChI InChI=1S/C24H22N4O2/c1-2-6-16(7-3-1)19-10-17-12-29-13-18(17)11-20(19)22-23-24(26-14-25-22)28(15-27-23)21-8-4-5-9-30-21/h1-3,6-7,10-11,14-15,21H,4-5,8-9,12-13H2
InChIKey WFPHEDVFRLEIDA-UHFFFAOYSA-N
Molecular Weight 398.466 g/mol
SMILES c1nc2c(ncnc2[n]1C1CCCCO1)-c1cc2COCc2cc1-c1ccccc1
SPLASH splash10-03fr-1049000000-4afa027acf8173a89750
Source of Spectrum F-69-9232-3
Synonyms 6-(6-phenylphthalan-5-yl)-9-tetrahydropyran-2-yl-purine 9-(2-oxanyl)-6-(6-phenyl-1,3-dihydroisobenzofuran-5-yl)purine 9-(oxan-2-yl)-6-(6-phenyl-1,3-dihydro-2-benzofuran-5-yl)purine
Wiley ID 1596022