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4-BROMOBUTANOYL-BORON-SUBPHTHALOCYANINE

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4-BROMOBUTANOYL-BORON-SUBPHTHALOCYANINE
SpectraBase Compound ID 9p0qPf2BhDs
InChI InChI=1S/C28H18BBrN6O2/c30-15-7-14-22(37)38-29-34-23-16-8-1-2-9-17(16)24(34)32-26-20-12-5-6-13-21(20)28(36(26)29)33-27-19-11-4-3-10-18(19)25(31-23)35(27)29/h1-6,8-13H,7,14-15H2
InChIKey JFQGRIBMKOBMFC-UHFFFAOYSA-N
Mol Weight 561.2 g/mol
Molecular Formula C28H18BBrN6O2
Exact Mass 560.076767 g/mol

11B Nuclear Magnetic Resonance (NMR) Chemical Shifts

11B Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3g7QgZwHayk
Name 4-BROMOBUTANOYL-BORON-SUBPHTHALOCYANINE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H18BBrN6O2
InChI InChI=1S/C28H18BBrN6O2/c30-15-7-14-22(37)38-29-34-23-16-8-1-2-9-17(16)24(34)32-26-20-12-5-6-13-21(20)28(36(26)29)33-27-19-11-4-3-10-18(19)25(31-23)35(27)29/h1-6,8-13H,7,14-15H2
InChIKey JFQGRIBMKOBMFC-UHFFFAOYSA-N
Literature Reference Author C.BONNIER,T.P.BENDER
Literature Reference Citation MOLECULES,20,18237(2015)
Literature Reference DOI 10.3390/molecules201018237
Solvent CDCl3
Source File Reference UWPA5301