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8-(4-Nitrophenyl)-10-phenylcarbamoyl-[1,2,4]-triazolo[4,3-a]perimidine
SpectraBase Compound ID JUxThypDpQF
InChI InChI=1S/C25H16N6O3/c32-24(26-17-8-2-1-3-9-17)23-28-30(18-12-14-19(15-13-18)31(33)34)25-27-20-10-4-6-16-7-5-11-21(22(16)20)29(23)25/h1-15H,(H,26,32)
InChIKey NZWGJCQXAANNEX-UHFFFAOYSA-N
Mol Weight 448.44 g/mol
Molecular Formula C25H16N6O3
Exact Mass 448.128388 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ECHQ4cINxgX
Name 8-(4-Nitrophenyl)-10-phenylcarbamoyl-[1,2,4]-triazolo[4,3-a]perimidine
Alternate Name(s) 8-(4-nitrophenyl)-N-phenyl-8H-[1,2,4]triazolo[4,3-a]perimidine-10-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H16N6O3
InChI InChI=1S/C25H16N6O3/c32-24(26-17-8-2-1-3-9-17)23-28-30(18-12-14-19(15-13-18)31(33)34)25-27-20-10-4-6-16-7-5-11-21(22(16)20)29(23)25/h1-15H,(H,26,32)
InChIKey NZWGJCQXAANNEX-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ardp.201200486
Molecular Weight 448.442 g/mol
SMILES N(C(C1=NN(c2ccc(cc2)[N+](=O)[O-])C2=Nc3cccc4cccc(c34)N12)=O)c1ccccc1
SPLASH splash10-00kb-0900000000-b38f1805a98d9c9b0cf9
Source of Spectrum APC-346-400-20d
Wiley ID 1769486