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3-Acetyl-1,9-diphenyl-1,4-dihydropyrazolo[3,4-d]pyrimido[1,2-b][1,2,4,5]tetrazin-6-one
SpectraBase Compound ID 7ItYeadL17H
InChI InChI=1S/C20H15N7O2/c1-13(28)17-23-26(15-10-6-3-7-11-15)20-22-18-16(19(29)27(20)24-17)12-21-25(18)14-8-4-2-5-9-14/h2-12H,1H3,(H,23,24)
InChIKey NMBMOJMVPCECKB-UHFFFAOYSA-N
Mol Weight 385.39 g/mol
Molecular Formula C20H15N7O2
Exact Mass 385.128723 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5db0R2LMBbY
Name 3-Acetyl-1,9-diphenyl-1,4-dihydropyrazolo[3,4-d]pyrimido[1,2-b][1,2,4,5]tetrazin-6-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H15N7O2
InChI InChI=1S/C20H15N7O2/c1-13(28)17-23-26(15-10-6-3-7-11-15)20-22-18-16(19(29)27(20)24-17)12-21-25(18)14-8-4-2-5-9-14/h2-12H,1H3,(H,23,24)
InChIKey NMBMOJMVPCECKB-UHFFFAOYSA-N
Literature Reference DOI 10.1002/jccs.200600123
Molecular Weight 385.387 g/mol
SMILES N1C(=NN(C=2N1C(c1c(N2)[n](nc1)-c1ccccc1)=O)c1ccccc1)C(=O)C
SPLASH splash10-002u-4019000000-f4865bdfaf7c99d89b5a
Source of Spectrum QA-53-926-6c
Synonyms 3-Acetyl-1,9-diphenyl-1,9-dihydropyrazolo[3',4':4,5]pyrimido[1,2-b][1,2,4,5]tetrazin-6(4H)-one
Wiley ID 1796220