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7-[2-[ethyl(2-acetoxyethyl)amino]ethyl]-3,7-dihydro-1,3-dimethyl-8-(phenylmethyl)-1H-purine-2,6-dione
SpectraBase Compound ID FRLoOcnr4L8
InChI InChI=1S/C22H29N5O4/c1-5-26(13-14-31-16(2)28)11-12-27-18(15-17-9-7-6-8-10-17)23-20-19(27)21(29)25(4)22(30)24(20)3/h6-10H,5,11-15H2,1-4H3
InChIKey STBKLSQEWVNQQI-UHFFFAOYSA-N
Mol Weight 427.51 g/mol
Molecular Formula C22H29N5O4
Exact Mass 427.221954 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CxaA3l6Ymbi
Name 7-[2-[ethyl(2-acetoxyethyl)amino]ethyl]-3,7-dihydro-1,3-dimethyl-8-(phenylmethyl)-1H-purine-2,6-dione
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Formula C22H29N5O4
InChI InChI=1S/C22H29N5O4/c1-5-26(13-14-31-16(2)28)11-12-27-18(15-17-9-7-6-8-10-17)23-20-19(27)21(29)25(4)22(30)24(20)3/h6-10H,5,11-15H2,1-4H3
InChIKey STBKLSQEWVNQQI-UHFFFAOYSA-N
Molecular Weight 427.505 g/mol
SMILES c12c(C(=O)N(C(N2C)=O)C)[n](CCN(CCOC(=O)C)CC)c(n1)Cc1ccccc1
SPLASH splash10-0006-2900000000-54cd408d18f1c07e3936
Source of Spectrum CJ-1992-0-0
Synonyms 2-[[2-(8-benzyl-1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)ethyl](ethyl)amino]ethyl acetate
Wiley ID 1380379