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3,6-Diphenylisoxazolo[4,5-d]pyrimidinone
SpectraBase Compound ID 5QhBXjKeNa9
InChI InChI=1S/C17H11N3O2/c21-17-18-16-14(11-20(17)13-9-5-2-6-10-13)22-19-15(16)12-7-3-1-4-8-12/h1-11H
InChIKey QQFJQXMHQYFBKJ-UHFFFAOYSA-N
Mol Weight 289.29 g/mol
Molecular Formula C17H11N3O2
Exact Mass 289.085127 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8V4dwoXpgJh
Name 3,6-Diphenylisoxazolo[4,5-d]pyrimidinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H11N3O2
InChI InChI=1S/C17H11N3O2/c21-17-18-16-14(11-20(17)13-9-5-2-6-10-13)22-19-15(16)12-7-3-1-4-8-12/h1-11H
InChIKey QQFJQXMHQYFBKJ-UHFFFAOYSA-N
Molecular Weight 289.294 g/mol
SMILES C12=NC(=O)N(C=C2ON=C1c1ccccc1)c1ccccc1
SPLASH splash10-0ug0-8790000000-61cb90b7260d4eb2a621
Source of Spectrum AN-103-182-5
Synonyms 3,6-Diphenylisoxazolo[4,5-d]pyrimidin-5(6H)-one
Wiley ID 747400