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5-Methyl-N-(4-nitrophenyl)-1-[2-(phenylselanyl)phenyl]-1H-1,2,3-triazole-4-carboxamide
SpectraBase Compound ID CNHX42TuC8x
InChI InChI=1S/C22H17N5O3Se/c1-15-21(22(28)23-16-11-13-17(14-12-16)27(29)30)24-25-26(15)19-9-5-6-10-20(19)31-18-7-3-2-4-8-18/h2-14H,1H3,(H,23,28)
InChIKey YLLOEDJNYHUQJS-UHFFFAOYSA-N
Mol Weight 478.38 g/mol
Molecular Formula C22H17N5O3Se
Exact Mass 479.049661 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GRG9r2LtvBW
Name 5-Methyl-N-(4-nitrophenyl)-1-[2-(phenylselanyl)phenyl]-1H-1,2,3-triazole-4-carboxamide
Alternate Name(s) 5-Methyl-N-(4-nitrophenyl)-1-(2-(phenylselanyl)phenyl)-1H-1,2,3-triazole-4-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H17N5O3Se
InChI InChI=1S/C22H17N5O3Se/c1-15-21(22(28)23-16-11-13-17(14-12-16)27(29)30)24-25-26(15)19-9-5-6-10-20(19)31-18-7-3-2-4-8-18/h2-14H,1H3,(H,23,28)
InChIKey YLLOEDJNYHUQJS-UHFFFAOYSA-N
Molecular Weight 478.382 g/mol
SMILES N(C(c1c([n](nn1)-c1c([Se]c2ccccc2)cccc1)C)=O)c1ccc(N(=O)=O)cc1
SPLASH splash10-0a4i-2379400000-78ad81574fc687fba2c6
Source of Spectrum U1-2014-1063-3k
Wiley ID 1740689