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1H-Purine-2,6-dione, 7-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-3,7-dihydro-1,3-dimethyl-8-(4-methyl-1-piperazinyl)-
SpectraBase Compound ID 90lM3xJ4WEt
InChI InChI=1S/C22H28N6O5/c1-24-8-10-27(11-9-24)21-23-19-18(20(30)26(3)22(31)25(19)2)28(21)13-15(29)14-6-7-16(32-4)17(12-14)33-5/h6-7,12H,8-11,13H2,1-5H3
InChIKey NJRBRWNFVVMLKU-UHFFFAOYSA-N
Mol Weight 456.5 g/mol
Molecular Formula C22H28N6O5
Exact Mass 456.212118 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3yNfdJkb2bs
Name 1H-Purine-2,6-dione, 7-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-3,7-dihydro-1,3-dimethyl-8-(4-methyl-1-piperazinyl)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H28N6O5
InChI InChI=1S/C22H28N6O5/c1-24-8-10-27(11-9-24)21-23-19-18(20(30)26(3)22(31)25(19)2)28(21)13-15(29)14-6-7-16(32-4)17(12-14)33-5/h6-7,12H,8-11,13H2,1-5H3
InChIKey NJRBRWNFVVMLKU-UHFFFAOYSA-N
Molecular Weight 456.503 g/mol
SMILES CN1C(N(C(c2c1nc([n]2CC(=O)c1cc(c(cc1)OC)OC)N1CCN(CC1)C)=O)C)=O
SPLASH splash10-00di-9411100000-af90d1c0ba82c05d1c4d
Source of Spectrum IY-1-4600-5
Synonyms 7-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-1,3-dimethyl-8-(4-methyl-1-piperazinyl)purine-2,6-dione 7-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-1,3-dimethyl-8-(4-methylpiperazin-1-yl)purine-2,6-dione 7-[2-(3,4-dimethoxyphenyl)-2-oxo-ethyl]-1,3-dimethyl-8-(4-methylpiperazin-1-yl)purine-2,6-dione 7-[2-(3,4-dimethoxyphenyl)-2-oxidanylidene-ethyl]-1,3-dimethyl-8-(4-methylpiperazin-1-yl)purine-2,6-dione
Wiley ID 1653988