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9-(Tetrahydropyran-2''-yl)-6-[2'-butyl-3',4',5',6''-tetraethylphenyl]-9H-purine
SpectraBase Compound ID 2aJ8gUXUADo
InChI InChI=1S/C28H40N4O/c1-6-11-14-23-21(9-4)19(7-2)20(8-3)22(10-5)25(23)26-27-28(30-17-29-26)32(18-31-27)24-15-12-13-16-33-24/h17-18,24H,6-16H2,1-5H3
InChIKey OZLKJGGKAXIXLD-UHFFFAOYSA-N
Mol Weight 448.7 g/mol
Molecular Formula C28H40N4O
Exact Mass 448.320212 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6mAYRUKJO3B
Name 9-(Tetrahydropyran-2''-yl)-6-[2'-butyl-3',4',5',6''-tetraethylphenyl]-9H-purine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H40N4O
InChI InChI=1S/C28H40N4O/c1-6-11-14-23-21(9-4)19(7-2)20(8-3)22(10-5)25(23)26-27-28(30-17-29-26)32(18-31-27)24-15-12-13-16-33-24/h17-18,24H,6-16H2,1-5H3
InChIKey OZLKJGGKAXIXLD-UHFFFAOYSA-N
Molecular Weight 448.655 g/mol
SMILES c12[n](cnc2c(-c2c(c(CC)c(c(c2CCCC)CC)CC)CC)ncn1)C1OCCCC1
SPLASH splash10-03di-1009000000-0f41c0c0c44021287397
Source of Spectrum Y2-70-346-3
Synonyms 6-(2-butyl-3,4,5,6-tetraethylphenyl)-9-tetrahydro-2H-pyran-2-yl-9H-purine
Wiley ID 1587455