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#10G2OH;[3-(3,5-BIS-DODECYLOXY-BENZYLOXY)-5-[3,5-BIS-[2-[2-[2-[2-[METHYL-[4-(4-NITROPHENYLAZO)-PHENYL]-AMINO]-ETHOXY]-ETHOXY]-ETHOXY]-ETHOXY]-BENZYLOXY]-PHENYL
SpectraBase Compound ID ARzM0HEG9R5
InChI InChI=1S/C87H120N8O17/c1-5-7-9-11-13-15-17-19-21-23-43-107-82-61-72(62-83(65-82)108-44-24-22-20-18-16-14-12-10-8-6-2)69-111-86-59-71(68-96)60-87(67-86)112-70-73-63-84(109-57-55-105-53-51-103-49-47-101-45-41-92(3)78-33-25-74(26-34-78)88-90-76-29-37-80(38-30-76)94(97)98)66-85(64-73)110-58-56-106-54-52-104-50-48-102-46-42-93(4)79-35-27-75(28-36-79)89-91-77-31-39-81(40-32-77)95(99)100/h25-40,59-67,96H,5-24,41-58,68-70H2,1-4H3/b90-88+,91-89+
InChIKey HZOADBYXEBGOAC-XZCZGYPASA-N
Mol Weight 1550.0 g/mol
Molecular Formula C87H120N8O17
Exact Mass 1548.877144 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GMPBhYN9fKC
Name #10G2OH;[3-(3,5-BIS-DODECYLOXY-BENZYLOXY)-5-[3,5-BIS-[2-[2-[2-[2-[METHYL-[4-(4-NITROPHENYLAZO)-PHENYL]-AMINO]-ETHOXY]-ETHOXY]-ETHOXY]-ETHOXY]-BENZYLOXY]-PHENYL
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C87H120N8O17
InChI InChI=1S/C87H120N8O17/c1-5-7-9-11-13-15-17-19-21-23-43-107-82-61-72(62-83(65-82)108-44-24-22-20-18-16-14-12-10-8-6-2)69-111-86-59-71(68-96)60-87(67-86)112-70-73-63-84(109-57-55-105-53-51-103-49-47-101-45-41-92(3)78-33-25-74(26-34-78)88-90-76-29-37-80(38-30-76)94(97)98)66-85(64-73)110-58-56-106-54-52-104-50-48-102-46-42-93(4)79-35-27-75(28-36-79)89-91-77-31-39-81(40-32-77)95(99)100/h25-40,59-67,96H,5-24,41-58,68-70H2,1-4H3/b90-88+,91-89+
InChIKey HZOADBYXEBGOAC-XZCZGYPASA-N
Literature Reference Author J.ORTIZ-PALACIOS,E.RODRIGUEZ-ALBA,M.AVELAR,A.MARTINEZ,M.D.P. CARREON-CASTRO,E.
Literature Reference Citation MOLECULES,18,1502(2013)
Literature Reference DOI 10.3390/molecules18021502
Molecular Weight 1549.953 g/mol
Solvent CDCl3
Source File Reference UWBT9121