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3-Phenyl-6-(4-chlorobenzyl)-1,2,4,5-tetrazine
SpectraBase Compound ID 5po6v87kmes
InChI InChI=1S/C15H11ClN4/c16-13-8-6-11(7-9-13)10-14-17-19-15(20-18-14)12-4-2-1-3-5-12/h1-9H,10H2
InChIKey VQQTVKGWSOKPAX-UHFFFAOYSA-N
Mol Weight 282.73 g/mol
Molecular Formula C15H11ClN4
Exact Mass 282.067224 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6IUjuMuZILo
Name 3-Phenyl-6-(4-chlorobenzyl)-1,2,4,5-tetrazine
Alternate Name(s) 3-[(4-chlorophenyl)methyl]-6-phenyl-1,2,4,5-tetrazine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H11ClN4
InChI InChI=1S/C15H11ClN4/c16-13-8-6-11(7-9-13)10-14-17-19-15(20-18-14)12-4-2-1-3-5-12/h1-9H,10H2
InChIKey VQQTVKGWSOKPAX-UHFFFAOYSA-N
Molecular Weight 282.734 g/mol
SMILES c1(nnc(nn1)Cc1ccc(cc1)Cl)-c1ccccc1
SPLASH splash10-0uxr-1900000000-2affa505d259aa4810c3
Source of Spectrum Y-45-1749-10c
Wiley ID 1666604