For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
N,N'-((9-ethyl-9H-carbazole-3,6-diyl)bis((1-cyclohexyl-1H-tetrazol-5-yl)methylene))bis(4-chloroaniline)
SpectraBase Compound ID 8aWycOSYnuf
InChI InChI=1S/C42H45Cl2N11/c1-2-53-37-23-13-27(39(45-31-19-15-29(43)16-20-31)41-47-49-51-54(41)33-9-5-3-6-10-33)25-35(37)36-26-28(14-24-38(36)53)40(46-32-21-17-30(44)18-22-32)42-48-50-52-55(42)34-11-7-4-8-12-34/h13-26,33-34,39-40,45-46H,2-12H2,1H3
InChIKey PHJJUQOYYMGFNM-UHFFFAOYSA-N
Mol Weight 774.8 g/mol
Molecular Formula C42H45Cl2N11
Exact Mass 773.323646 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID E3rqMau2ExM
Name N,N'-((9-ethyl-9H-carbazole-3,6-diyl)bis((1-cyclohexyl-1H-tetrazol-5-yl)methylene))bis(4-chloroaniline)
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C42H45Cl2N11
InChI InChI=1S/C42H45Cl2N11/c1-2-53-37-23-13-27(39(45-31-19-15-29(43)16-20-31)41-47-49-51-54(41)33-9-5-3-6-10-33)25-35(37)36-26-28(14-24-38(36)53)40(46-32-21-17-30(44)18-22-32)42-48-50-52-55(42)34-11-7-4-8-12-34/h13-26,33-34,39-40,45-46H,2-12H2,1H3
InChIKey PHJJUQOYYMGFNM-UHFFFAOYSA-N
Instrument Name Agilent HP 5937
Ionization Type EI
Literature Reference DOI 10.1002/jhet.4206
Molecular Weight 774.805 g/mol
SMILES N(C(c1ccc2[n](c3ccc(C(c4nnn[n]4C4CCCCC4)Nc4ccc(cc4)Cl)cc3c2c1)CC)c1nnn[n]1C1CCCCC1)c1ccc(cc1)Cl
SPLASH splash10-0a4i-9123000000-3e49e590d2b97a62f7cc
Source of Spectrum Y-58-722-6k
Wiley ID 1879371