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5-(2-Morpholin-4-yl acetamido)-3-methyl-1-phenyl-1H-selenolo[3,2-e]pyrazolo [3,4-b]pyrazine-6-carbonitrile
SpectraBase Compound ID 2cAo6nxnXhJ
InChI InChI=1S/C21H19N7O2Se/c1-13-17-20(28(26-13)14-5-3-2-4-6-14)25-21-19(24-17)18(15(11-22)31-21)23-16(29)12-27-7-9-30-10-8-27/h2-6H,7-10,12H2,1H3,(H,23,29)
InChIKey QMHWMQDXPCTIPR-UHFFFAOYSA-N
Mol Weight 480.4 g/mol
Molecular Formula C21H19N7O2Se
Exact Mass 481.076545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BdC1YbtmuuT
Name 5-(2-Morpholin-4-yl acetamido)-3-methyl-1-phenyl-1H-selenolo[3,2-e]pyrazolo [3,4-b]pyrazine-6-carbonitrile
Appearance Yellow crystals
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H19N7O2Se
InChI InChI=1S/C21H19N7O2Se/c1-13-17-20(28(26-13)14-5-3-2-4-6-14)25-21-19(24-17)18(15(11-22)31-21)23-16(29)12-27-7-9-30-10-8-27/h2-6H,7-10,12H2,1H3,(H,23,29)
InChIKey QMHWMQDXPCTIPR-UHFFFAOYSA-N
Instrument Name Shimadzu Qp-2010
Ionization Type EI
Literature Reference DOI 10.1002/jhet.4330
Molecular Weight 480.402 g/mol
SMILES N(c1c([se]c2nc3[n](nc(c3nc12)C)-c1ccccc1)C#N)C(CN1CCOCC1)=O
SPLASH splash10-0udi-1529400000-3df43a74b5f603ae5d3c
Source of Spectrum Y-58-SM47-13
Wiley ID 1880873