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6-[(Formyloxy)methyl]-1-(4-methlyphenyl)-3-(4-methoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidine
SpectraBase Compound ID CXHpVqd7A6F
InChI InChI=1S/C21H18N4O3/c1-14-3-7-16(8-4-14)25-21-18(11-22-19(23-21)12-28-13-26)20(24-25)15-5-9-17(27-2)10-6-15/h3-11,13H,12H2,1-2H3
InChIKey RCZZXBAJDJOOBW-UHFFFAOYSA-N
Mol Weight 374.4 g/mol
Molecular Formula C21H18N4O3
Exact Mass 374.13789 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AgI3ygdx4BI
Name 6-[(Formyloxy)methyl]-1-(4-methlyphenyl)-3-(4-methoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H18N4O3
InChI InChI=1S/C21H18N4O3/c1-14-3-7-16(8-4-14)25-21-18(11-22-19(23-21)12-28-13-26)20(24-25)15-5-9-17(27-2)10-6-15/h3-11,13H,12H2,1-2H3
InChIKey RCZZXBAJDJOOBW-UHFFFAOYSA-N
Literature Reference DOI 10.1039/C5RA07707A
Molecular Weight 374.400 g/mol
SMILES c1(nc2c(cn1)c(n[n]2-c1ccc(cc1)C)-c1ccc(cc1)OC)COC=O
SPLASH splash10-00fs-3619000000-804def23e8eb6b9aab65
Source of Spectrum RSA-5-47105-30
Synonyms (3-(4-methoxyphenyl)-1-(p-tolyl)-1H-pyrazolo[3,4-d]pyrimidin-6-yl)methyl formate
Wiley ID 1805551