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5-[2,6-bis(4-methylphenyl)phenyl]-2-(2-phenylpropan-2-yl)-1,2,3,4-tetrazole
SpectraBase Compound ID GE6foo1oXfY
InChI InChI=1S/C30H28N4/c1-21-13-17-23(18-14-21)26-11-8-12-27(24-19-15-22(2)16-20-24)28(26)29-31-33-34(32-29)30(3,4)25-9-6-5-7-10-25/h5-20H,1-4H3
InChIKey XBSGQRYWNOJQKK-UHFFFAOYSA-N
Mol Weight 444.58 g/mol
Molecular Formula C30H28N4
Exact Mass 444.231397 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Im0UlAmgCgz
Name 5-[2,6-bis(4-methylphenyl)phenyl]-2-(2-phenylpropan-2-yl)-1,2,3,4-tetrazole
Alternate Name(s) 5-[2,6-bis(4-methylphenyl)phenyl]-2-(2-phenylpropan-2-yl)tetrazole 5-[2,6-bis(p-tolyl)phenyl]-2-(1-methyl-1-phenyl-ethyl)tetrazole 5-[2,6-bis(p-tolyl)phenyl]-2-cumyl-tetrazole
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H28N4
InChI InChI=1S/C30H28N4/c1-21-13-17-23(18-14-21)26-11-8-12-27(24-19-15-22(2)16-20-24)28(26)29-31-33-34(32-29)30(3,4)25-9-6-5-7-10-25/h5-20H,1-4H3
InChIKey XBSGQRYWNOJQKK-UHFFFAOYSA-N
Molecular Weight 444.582 g/mol
SMILES c1(n[n](C(c2ccccc2)(C)C)nn1)-c1c(-c2ccc(cc2)C)cccc1-c1ccc(cc1)C
SPLASH splash10-014l-0090600000-b83e3ff300528133fb93
Source of Spectrum J-64-9305-19
Wiley ID 1531824