N,N'-(6,6,12,12,15,15-HEXAHEXYL-3,9-DINITRO-12,15-DIHYDRO-6H-CYCLOPENTA-[1,2-B:5,4-B']-DIFLUORENE-2,10-DIYL)-DIACETAMIDE

SpectraBase Compound ID	KN2mnDou0aE
InChI	InChI=1S/C67H94N4O6/c1-9-15-21-27-33-65(34-28-22-16-10-2)55-41-51-53-43-63(70(74)75)61(68-47(7)72)45-59(53)66(35-29-23-17-11-3,36-30-24-18-12-4)57(51)39-49(55)50-40-58-52(42-56(50)65)54-44-64(71(76)77)62(69-48(8)73)46-60(54)67(58,37-31-25-19-13-5)38-32-26-20-14-6/h39-46H,9-38H2,1-8H3,(H,68,72)(H,69,73)
InChIKey	LJVSYHAKGKKDBT-UHFFFAOYSA-N Google Search
Mol Weight	1051.5 g/mol
Molecular Formula	C67H94N4O6
Exact Mass	1050.717337 g/mol

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SpectraBase Spectrum ID	8xNraSJwR2j
Name	N,N'-(6,6,12,12,15,15-HEXAHEXYL-3,9-DINITRO-12,15-DIHYDRO-6H-CYCLOPENTA-[1,2-B:5,4-B']-DIFLUORENE-2,10-DIYL)-DIACETAMIDE
Compound Number	9A
Copyright	Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula	C67H94N4O6
InChI	InChI=1S/C67H94N4O6/c1-9-15-21-27-33-65(34-28-22-16-10-2)55-41-51-53-43-63(70(74)75)61(68-47(7)72)45-59(53)66(35-29-23-17-11-3,36-30-24-18-12-4)57(51)39-49(55)50-40-58-52(42-56(50)65)54-44-64(71(76)77)62(69-48(8)73)46-60(54)67(58,37-31-25-19-13-5)38-32-26-20-14-6/h39-46H,9-38H2,1-8H3,(H,68,72)(H,69,73)
InChIKey	LJVSYHAKGKKDBT-UHFFFAOYSA-N
Literature Reference Author	T.C.LIN,B.K.TSAI,Y.Y.LIU,M.Y.TSAI
Literature Reference Citation	EUR.J.ORG.CHEM.,2014,6163(2014)
Literature Reference DOI	10.1002/ejoc.201402622
Molecular Weight	1051.507 g/mol
Solvent	CDCl3
Source File Reference	UWLU85388