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2,2'-Diphenylbis[3-aza-2-bora-1-oxabicyclo[4.4.0]decano][4.4]metacyclophane
SpectraBase Compound ID CzgRM4nkpQJ
InChI InChI=1S/C40H32B2N2O4/c1-3-17-35(18-4-1)41-43(27-33-15-7-9-23-39(33)47-41)37-21-11-14-32(25-37)30-46-42(36-19-5-2-6-20-36)44(28-34-16-8-10-24-40(34)48-42)38-22-12-13-31(26-38)29-45-41/h1-28H,29-30H2
InChIKey NNGZUIIGILGHCQ-UHFFFAOYSA-N
Mol Weight 626.3 g/mol
Molecular Formula C40H32B2N2O4
Exact Mass 626.254818 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HiTPMD3VNVp
Name 2,2'-Diphenylbis[3-aza-2-bora-1-oxabicyclo[4.4.0]decano][4.4]metacyclophane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C40H32B2N2O4
InChI InChI=1S/C40H32B2N2O4/c1-3-17-35(18-4-1)41-43(27-33-15-7-9-23-39(33)47-41)37-21-11-14-32(25-37)30-46-42(36-19-5-2-6-20-36)44(28-34-16-8-10-24-40(34)48-42)38-22-12-13-31(26-38)29-45-41/h1-28H,29-30H2
InChIKey NNGZUIIGILGHCQ-UHFFFAOYSA-N
Molecular Weight 626.326 g/mol
SMILES C1=[N]2[B](Oc3c1cccc3)(OCc1cc([N]=3[B](OCc4cc2ccc4)(Oc2c(C3)cccc2)c2ccccc2)ccc1)c1ccccc1
SPLASH splash10-03di-5189040000-5c72823e5557c95f07ce
Source of Spectrum QE-8-619-3
Wiley ID 1557119