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6-(4-Nitrophenyl)-3-phenyl-4H-[1,2,3]triazolo[1,5-d][1,3,4]oxadiazin-4-one
SpectraBase Compound ID LmAddxrOYEQ
InChI InChI=1S/C16H9N5O4/c22-16-14-13(10-4-2-1-3-5-10)17-19-20(14)18-15(25-16)11-6-8-12(9-7-11)21(23)24/h1-9H
InChIKey YDUBJFHDBATBBS-UHFFFAOYSA-N
Mol Weight 335.28 g/mol
Molecular Formula C16H9N5O4
Exact Mass 335.065454 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IHqCZtwlC54
Name 6-(4-Nitrophenyl)-3-phenyl-4H-[1,2,3]triazolo[1,5-d][1,3,4]oxadiazin-4-one
CAS Registry Number 113631-81-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H9N5O4
InChI InChI=1S/C16H9N5O4/c22-16-14-13(10-4-2-1-3-5-10)17-19-20(14)18-15(25-16)11-6-8-12(9-7-11)21(23)24/h1-9H
InChIKey YDUBJFHDBATBBS-UHFFFAOYSA-N
Molecular Weight 335.279 g/mol
SMILES c1ccc(cc1)-c1c2C(=O)OC(c3ccc(cc3)N(=O)=O)=N[n]2nn1
SPLASH splash10-004i-1900000000-8f9e121f710566e69376
Source of Spectrum Y-24-1278-8
Synonyms 3-Phenyl-6-(4-nitrophenyl)-4H-(1,2,3)triazolo(1,5-d)(1,3,4)oxadiazin-4-one 6-(4-nitrophenyl)-3-phenyl-4-triazolo[1,5-d][1,3,4]oxadiazinone 6-(4-nitrophenyl)-3-phenyl-triazolo[1,5-d][1,3,4]oxadiazin-4-one 6-(4-nitrophenyl)-3-phenyl-[1,2,3]triazolo[1,5-d][1,3,4]oxadiazin-4-one
Wiley ID 1331576