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N,N'-((9-ethyl-9H-carbazole-3,6-diyl)bis((1-(tert-butyl)-1H-tetrazol-5-yl)methylene))bis(4-methylaniline)
SpectraBase Compound ID 7oA8l91T5Ys
InChI InChI=1S/C40H47N11/c1-10-49-33-21-15-27(35(41-29-17-11-25(2)12-18-29)37-43-45-47-50(37)39(4,5)6)23-31(33)32-24-28(16-22-34(32)49)36(42-30-19-13-26(3)14-20-30)38-44-46-48-51(38)40(7,8)9/h11-24,35-36,41-42H,10H2,1-9H3
InChIKey PLYILYYPYMTSMK-UHFFFAOYSA-N
Mol Weight 681.9 g/mol
Molecular Formula C40H47N11
Exact Mass 681.401591 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ETXgTz5doe0
Name N,N'-((9-ethyl-9H-carbazole-3,6-diyl)bis((1-(tert-butyl)-1H-tetrazol-5-yl)methylene))bis(4-methylaniline)
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C40H47N11
InChI InChI=1S/C40H47N11/c1-10-49-33-21-15-27(35(41-29-17-11-25(2)12-18-29)37-43-45-47-50(37)39(4,5)6)23-31(33)32-24-28(16-22-34(32)49)36(42-30-19-13-26(3)14-20-30)38-44-46-48-51(38)40(7,8)9/h11-24,35-36,41-42H,10H2,1-9H3
InChIKey PLYILYYPYMTSMK-UHFFFAOYSA-N
Instrument Name Agilent HP 5937
Ionization Type EI
Literature Reference DOI 10.1002/jhet.4206
Molecular Weight 681.893 g/mol
SMILES N(C(c1ccc2[n](c3ccc(C(c4nnn[n]4C(C)(C)C)Nc4ccc(cc4)C)cc3c2c1)CC)c1nnn[n]1C(C)(C)C)c1ccc(cc1)C
SPLASH splash10-0a4i-9021000000-e69540b094b527dde619
Source of Spectrum Y-58-721-6d
Wiley ID 1879365