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2,9,16-TRINEOPENTOXY-31H,33H-TRIBENZO-[B,G,L]-NAPHTO-[2,3-Q]-PORPHYRAZINE
SpectraBase Compound ID 2rQtZhjLVic
InChI InChI=1S/C51H48N8O3/c1-49(2,3)25-60-30-14-17-33-38(22-30)46-53-41(33)52-44-36-20-28-12-10-11-13-29(28)21-37(36)45(58-44)59-48-40-24-32(62-27-51(7,8)9)16-19-35(40)43(57-48)56-47-39-23-31(61-26-50(4,5)6)15-18-34(39)42(54-46)55-47/h10-24H,25-27H2,1-9H3/b52-41-,52-44-,54-42-,54-46-,56-43-,56-47-,59-45-,59-48-
InChIKey CLAFADHLQQMGAT-ILPJNRLQSA-N
Mol Weight 821.0 g/mol
Molecular Formula C51H48N8O3
Exact Mass 820.384937 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3VxsdsUfxNL
Name 2,9,16-TRINEOPENTOXY-31H,33H-TRIBENZO-[B,G,L]-NAPHTO-[2,3-Q]-PORPHYRAZINE
Compound Number 18
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C51H48N8O3
InChI InChI=1S/C51H48N8O3/c1-49(2,3)25-60-30-14-17-33-38(22-30)46-53-41(33)52-44-36-20-28-12-10-11-13-29(28)21-37(36)45(58-44)59-48-40-24-32(62-27-51(7,8)9)16-19-35(40)43(57-48)56-47-39-23-31(61-26-50(4,5)6)15-18-34(39)42(54-46)55-47/h10-24H,25-27H2,1-9H3/b52-41-,52-44-,54-42-,54-46-,56-43-,56-47-,59-45-,59-48-
InChIKey CLAFADHLQQMGAT-ILPJNRLQSA-N
Literature Reference Author C.C.LEZNOFF,C.R.MCARTHUR,Y.QIN
Literature Reference Citation CAN.J.CHEM.,71,1319(1993)
Literature Reference DOI 10.1139/v93-170
Molecular Weight 820.994 g/mol
Solvent TOLUENE-D8
Source File Reference UWVP5327