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QJZZTGGXENJHQF-UHFFFAOYSA-N

View entire compound with spectra: 2 NMR

QJZZTGGXENJHQF-UHFFFAOYSA-N
SpectraBase Compound ID BxgVowUYD3r
InChI InChI=1S/C66H64N4P4.2BrH/c1-11-31-55(32-12-1)65-67-71(57-35-15-3-16-36-57,58-37-17-4-18-38-58)51-53-73(61-43-23-7-24-44-61,62-45-25-8-26-46-62)69-66(56-33-13-2-14-34-56)70-74(63-47-27-9-28-48-63,64-49-29-10-30-50-64)54-52-72(68-65,59-39-19-5-20-40-59)60-41-21-6-22-42-60;;/h1-50,71-74H,51-54H2,(H,67,68)(H,69,70);2*1H
InChIKey QJZZTGGXENJHQF-UHFFFAOYSA-N
Mol Weight 1198.985 g/mol
Molecular Formula C66H66Br2N4P4
Exact Mass 1196.260472 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID COvy8Ca5wSv
Name QJZZTGGXENJHQF-UHFFFAOYSA-N
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C66H62Br2N4P4
InChI InChI=1S/C66H64N4P4.2BrH/c1-11-31-55(32-12-1)65-67-71(57-35-15-3-16-36-57,58-37-17-4-18-38-58)51-53-73(61-43-23-7-24-44-61,62-45-25-8-26-46-62)69-66(56-33-13-2-14-34-56)70-74(63-47-27-9-28-48-63,64-49-29-10-30-50-64)54-52-72(68-65,59-39-19-5-20-40-59)60-41-21-6-22-42-60;;/h1-50,71-74H,51-54H2,(H,67,68)(H,69,70);2*1H
InChIKey QJZZTGGXENJHQF-UHFFFAOYSA-N
Literature Reference Author G.ALCARAZ,V.PIQUET,A.BACEIREDO,F.DAHAN,W.W.SCHOELLER,G.BERTR AND
Literature Reference Citation J.AM.CHEM.SOC.,118,1060(1996)
Literature Reference DOI 10.1021/ja9532143
Molecular Weight 1194.948 g/mol
Sample ID 36169
Solvent CDCl3