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2,21,23,42-Tetraoxa-1,22(1,3,4)-dibenzena-43(2,9)-1,10-phenanthrolinabicyclo[20.20.1]tritetracontaphan-11,32-diene
SpectraBase Compound ID 7ihc83ci0Sv
InChI InChI=1S/C60H80N2O4/c1-2-6-10-14-18-22-26-30-44-64-52-38-40-54-56-42-36-50-34-33-49-35-41-55(61-59(49)60(50)62-56)53-39-37-51(63-43-29-25-21-17-13-9-5-1)47-57(53)65-45-31-27-23-19-15-11-7-3-4-8-12-16-20-24-28-32-46-66-58(54)48-52/h1-4,33-42,47-48H,5-32,43-46H2/b2-1-,4-3-
InChIKey JGNMIWKJBQXLRI-LOKDLIDFSA-N
Mol Weight 893.3 g/mol
Molecular Formula C60H80N2O4
Exact Mass 892.611809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6WCz0tH1cKL
Name 2,21,23,42-Tetraoxa-1,22(1,3,4)-dibenzena-43(2,9)-1,10-phenanthrolinabicyclo[20.20.1]tritetracontaphan-11,32-diene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C60H80N2O4
InChI InChI=1S/C60H80N2O4/c1-2-6-10-14-18-22-26-30-44-64-52-38-40-54-56-42-36-50-34-33-49-35-41-55(61-59(49)60(50)62-56)53-39-37-51(63-43-29-25-21-17-13-9-5-1)47-57(53)65-45-31-27-23-19-15-11-7-3-4-8-12-16-20-24-28-32-46-66-58(54)48-52/h1-4,33-42,47-48H,5-32,43-46H2/b2-1-,4-3-
InChIKey JGNMIWKJBQXLRI-LOKDLIDFSA-N
Molecular Weight 893.310 g/mol
SMILES c12nc3-c4ccc5OCCCCCCCC\C=C/CCCCCCCCOc6cc(c(-c7nc2c(ccc1cc3)cc7)cc6)OCCCCCCCC\C=C/CCCCCCCCOc4c5
SPLASH splash10-0002-9000000000-41d61622b805f6e1ece9
Source of Spectrum U1-2009-2338-24b
Wiley ID 1662878