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6-[(Formyloxy)methyl]-1-(3-methylphenyl)-3-phenyl-1H-pyrazolo[3,4-d]pyrimidine
SpectraBase Compound ID 8N9Qm4Txmfi
InChI InChI=1S/C20H16N4O2/c1-14-6-5-9-16(10-14)24-20-17(11-21-18(22-20)12-26-13-25)19(23-24)15-7-3-2-4-8-15/h2-11,13H,12H2,1H3
InChIKey JCMIIKXBUMQGBV-UHFFFAOYSA-N
Mol Weight 344.37 g/mol
Molecular Formula C20H16N4O2
Exact Mass 344.127326 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ALa8jravDqm
Name 6-[(Formyloxy)methyl]-1-(3-methylphenyl)-3-phenyl-1H-pyrazolo[3,4-d]pyrimidine
Alternate Name(s) (3-phenyl-1-(m-tolyl)-1H-pyrazolo[3,4-d]pyrimidin-6-yl)methyl formate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H16N4O2
InChI InChI=1S/C20H16N4O2/c1-14-6-5-9-16(10-14)24-20-17(11-21-18(22-20)12-26-13-25)19(23-24)15-7-3-2-4-8-15/h2-11,13H,12H2,1H3
InChIKey JCMIIKXBUMQGBV-UHFFFAOYSA-N
Literature Reference DOI 10.1039/C5RA07707A
Molecular Weight 344.374 g/mol
SMILES c1(nc2c(cn1)c(n[n]2-c1cc(ccc1)C)-c1ccccc1)COC=O
SPLASH splash10-0002-4940000000-59e9b5357952b982a608
Source of Spectrum RSA-5-47104-19
Wiley ID 1805540