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2,7-Bis(1-(4-bromophenyl)-1H-pyrazol-4-yl)-1,1,6,6-tetramethyl-1,6-dihydroindolo[7,6-g]indole
SpectraBase Compound ID 3W6RFfUdSei
InChI InChI=1S/C36H28Br2N6/c1-35(2)29-15-13-28-27(31(29)41-33(35)21-17-39-43(19-21)25-9-5-23(37)6-10-25)14-16-30-32(28)42-34(36(30,3)4)22-18-40-44(20-22)26-11-7-24(38)8-12-26/h5-20H,1-4H3
InChIKey HIRRSQBXQXSYPU-UHFFFAOYSA-N
Mol Weight 704.5 g/mol
Molecular Formula C36H28Br2N6
Exact Mass 702.074221 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Vbm5tjWq7g
Name 2,7-Bis(1-(4-bromophenyl)-1H-pyrazol-4-yl)-1,1,6,6-tetramethyl-1,6-dihydroindolo[7,6-g]indole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H28Br2N6
InChI InChI=1S/C36H28Br2N6/c1-35(2)29-15-13-28-27(31(29)41-33(35)21-17-39-43(19-21)25-9-5-23(37)6-10-25)14-16-30-32(28)42-34(36(30,3)4)22-18-40-44(20-22)26-11-7-24(38)8-12-26/h5-20H,1-4H3
InChIKey HIRRSQBXQXSYPU-UHFFFAOYSA-N
Instrument Name Agilent Technology HP 5973
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0012.220
Molecular Weight 704.470 g/mol
SMILES C1(C(=Nc2c3c(ccc12)c1N=C(C(c1cc3)(C)C)c1c[n](nc1)-c1ccc(cc1)Br)c1cn[n](c1)-c1ccc(cc1)Br)(C)C
SPLASH splash10-0abc-3100911000-fe2b82dd7938adf47a7b
Source of Spectrum ARK-2011-259-16e
Wiley ID 1864401