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DIBrOMO-[2,3,7,8-TETRAHYDRO-2,2,3,3,7,7,8,8-OCTAMETHYL-N(1),N(9)-(2,2,2',2'-TETRAMETHYL-[(3,4,5,6-TETRAMETHYLPHEN-1,2-YLEN)-DINITRILO]-BIS-[PROPYL])-11H-DIPYRR

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DIBrOMO-[2,3,7,8-TETRAHYDRO-2,2,3,3,7,7,8,8-OCTAMETHYL-N(1),N(9)-(2,2,2',2'-TETRAMETHYL-[(3,4,5,6-TETRAMETHYLPHEN-1,2-YLEN)-DINITRILO]-BIS-[PROPYL])-11H-DIPYRR
SpectraBase Compound ID IaUlMFkPBn1
InChI InChI=1S/C37H55N6.2BrH.Co/c1-20-21(2)23(4)27-26(22(20)3)40-28(32(5,6)7)42-30-36(15,16)34(11,12)24(38-30)19-25-35(13,14)37(17,18)31(39-25)43-29(41-27)33(8,9)10;;;/h19H,1-18H3;2*1H;/q-1;;;+3/p-2/b24-19-,41-29?,43-31-;;;
InChIKey YVQDOEGESYQIPL-DCUSOESBSA-L
Mol Weight 802.6 g/mol
Molecular Formula C37H55Br2CoN6
Exact Mass 800.218691 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Hgg7qcxtnNv
Name DIBrOMO-[2,3,7,8-TETRAHYDRO-2,2,3,3,7,7,8,8-OCTAMETHYL-N(1),N(9)-(2,2,2',2'-TETRAMETHYL-[(3,4,5,6-TETRAMETHYLPHEN-1,2-YLEN)-DINITRILO]-BIS-[PROPYL])-11H-DIPYRR
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H55Br2CoN6
InChI InChI=1S/C37H55N6.2BrH.Co/c1-20-21(2)23(4)27-26(22(20)3)40-28(32(5,6)7)42-30-36(15,16)34(11,12)24(38-30)19-25-35(13,14)37(17,18)31(39-25)43-29(41-27)33(8,9)10;;;/h19H,1-18H3;2*1H;/q-1;;;+3/p-2/b24-19-,41-29?,43-31-;;;
InChIKey YVQDOEGESYQIPL-DCUSOESBSA-L
Literature Reference Author R.HAERTER,C.WEYMUTH,R.SCHEFFOLD,P.ENGEL,A.LINDEN
Literature Reference Citation HELV.CHIM.ACTA,76,353(1993)
Literature Reference DOI 10.1002/hlca.19930760120
Molecular Weight 802.625 g/mol
Solvent CDCl3
Source File Reference UWCS15175