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N,N'-((9-ethyl-9H-carbazole-3,6-diyl)bis((1-(tert-butyl)-1H-tetrazol-5-yl)methylene))bis(4-chloroaniline)
SpectraBase Compound ID Ef7VtuLex8U
InChI InChI=1S/C38H41Cl2N11/c1-8-49-31-19-9-23(33(41-27-15-11-25(39)12-16-27)35-43-45-47-50(35)37(2,3)4)21-29(31)30-22-24(10-20-32(30)49)34(42-28-17-13-26(40)14-18-28)36-44-46-48-51(36)38(5,6)7/h9-22,33-34,41-42H,8H2,1-7H3
InChIKey ZZSWPLUYLUMAPA-UHFFFAOYSA-N
Mol Weight 722.7 g/mol
Molecular Formula C38H41Cl2N11
Exact Mass 721.292346 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Amhcwxj9gmf
Name N,N'-((9-ethyl-9H-carbazole-3,6-diyl)bis((1-(tert-butyl)-1H-tetrazol-5-yl)methylene))bis(4-chloroaniline)
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C38H41Cl2N11
InChI InChI=1S/C38H41Cl2N11/c1-8-49-31-19-9-23(33(41-27-15-11-25(39)12-16-27)35-43-45-47-50(35)37(2,3)4)21-29(31)30-22-24(10-20-32(30)49)34(42-28-17-13-26(40)14-18-28)36-44-46-48-51(36)38(5,6)7/h9-22,33-34,41-42H,8H2,1-7H3
InChIKey ZZSWPLUYLUMAPA-UHFFFAOYSA-N
Instrument Name Agilent HP 5937
Ionization Type EI
Literature Reference DOI 10.1002/jhet.4206
Molecular Weight 722.729 g/mol
SMILES N(C(c1ccc2[n](c3ccc(C(c4nnn[n]4C(C)(C)C)Nc4ccc(cc4)Cl)cc3c2c1)CC)c1nnn[n]1C(C)(C)C)c1ccc(cc1)Cl
SPLASH splash10-0a4i-9486000000-39cbbe302e301095d4ae
Source of Spectrum Y-58-722-6i
Wiley ID 1879369