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6,6'-((4-Nitrophenyl)methylene)bis(benzo[a]phenazin-5-ol)
SpectraBase Compound ID Al8VX9pXY4E
InChI InChI=1S/C39H23N5O4/c45-38-25-11-3-1-9-23(25)34-36(42-29-15-7-5-13-27(29)40-34)32(38)31(21-17-19-22(20-18-21)44(47)48)33-37-35(24-10-2-4-12-26(24)39(33)46)41-28-14-6-8-16-30(28)43-37/h1-20,31,45-46H
InChIKey XTMRMHGNZZKTSJ-UHFFFAOYSA-N
Mol Weight 625.6 g/mol
Molecular Formula C39H23N5O4
Exact Mass 625.175004 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2OMItThuwic
Name 6,6'-((4-Nitrophenyl)methylene)bis(benzo[a]phenazin-5-ol)
Appearance Crimson powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C39H23N5O4
InChI InChI=1S/C39H23N5O4/c45-38-25-11-3-1-9-23(25)34-36(42-29-15-7-5-13-27(29)40-34)32(38)31(21-17-19-22(20-18-21)44(47)48)33-37-35(24-10-2-4-12-26(24)39(33)46)41-28-14-6-8-16-30(28)43-37/h1-20,31,45-46H
InChIKey XTMRMHGNZZKTSJ-UHFFFAOYSA-N
Instrument Name Aligent HP 5973
Ionization Type EI
Literature Reference DOI 10.1002/jccs.202000354
Molecular Weight 625.644 g/mol
SMILES Oc1c(C(c2c(c3c(c4nc5ccccc5nc24)cccc3)O)c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3nc2c2c1cccc2
SPLASH splash10-001r-9030000000-9807270e081a977f3526
Source of Spectrum QA-68-709-5a
Wiley ID 1871887