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6-(2-nitrophenyl)-3-phenyl-4-triazolo[1,5-d][1,3,4]oxadiazinone

View entire compound with spectra: 2 MS (GC)

6-(2-nitrophenyl)-3-phenyl-4-triazolo[1,5-d][1,3,4]oxadiazinone
SpectraBase Compound ID HNPoZ60olBu
InChI InChI=1S/C16H9N5O4/c22-16-14-13(10-6-2-1-3-7-10)17-19-20(14)18-15(25-16)11-8-4-5-9-12(11)21(23)24/h1-9H
InChIKey HWDYEDSMIATNQN-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 hnnBS7Enma
Name 6-(2-nitrophenyl)-3-phenyl-4-triazolo[1,5-d][1,3,4]oxadiazinone
Alternate Name(s) 6-(2-nitrophenyl)-3-phenyl-triazolo[1,5-d][1,3,4]oxadiazin-4-one 6-(2-nitrophenyl)-3-phenyl-[1,2,3]triazolo[1,5-d][1,3,4]oxadiazin-4-one
CAS Registry Number 113631-82-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H9N5O4
InChI InChI=1S/C16H9N5O4/c22-16-14-13(10-6-2-1-3-7-10)17-19-20(14)18-15(25-16)11-8-4-5-9-12(11)21(23)24/h1-9H
InChIKey HWDYEDSMIATNQN-UHFFFAOYSA-N
Molecular Weight 335.279 g/mol
SMILES c12[n](N=C(OC2=O)c2c(N(=O)=O)cccc2)nnc1-c1ccccc1
SPLASH splash10-004i-0900000000-d825368fe96792e275a3
Source of Spectrum O-24-425-4
Wiley ID 1331575