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3-(4-Bromophenyl)-1-methyl-4,6-diphenyl-1,2,3,4-tetrahydro-[1,2,4,5]tetrazine
SpectraBase Compound ID Zr7U9HMijz
InChI InChI=1S/C21H19BrN4/c1-25-20(16-8-4-2-5-9-16)24-26(19-10-6-3-7-11-19)21(23-25)17-12-14-18(22)15-13-17/h2-15,21,23H,1H3
InChIKey HKUPRYMIVJAODN-UHFFFAOYSA-N
Mol Weight 407.32 g/mol
Molecular Formula C21H19BrN4
Exact Mass 406.07931 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CEECq2qrjji
Name 3-(4-Bromophenyl)-1-methyl-4,6-diphenyl-1,2,3,4-tetrahydro-[1,2,4,5]tetrazine
Alternate Name(s) 3-(4-Bromophenyl)-1-methyl-4,6-diphenyl-1,2,3,4-tetrahydro-1,2,4,5-tetraazine 6-(4-bromophenyl)-2-methyl-3,5-diphenyl-1,6-dihydro-1,2,4,5-tetrazine
CAS Registry Number 155828-44-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H19BrN4
InChI InChI=1S/C21H19BrN4/c1-25-20(16-8-4-2-5-9-16)24-26(19-10-6-3-7-11-19)21(23-25)17-12-14-18(22)15-13-17/h2-15,21,23H,1H3
InChIKey HKUPRYMIVJAODN-UHFFFAOYSA-N
Molecular Weight 407.315 g/mol
SMILES N1N(C(=NN(C1c1ccc(cc1)Br)c1ccccc1)c1ccccc1)C
SPLASH splash10-014l-9721100000-9928b5bcdfcaae750cfb
Wiley ID 1474510