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XBOHGSBHSGATBH-BPZHABKHSA-N

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XBOHGSBHSGATBH-BPZHABKHSA-N
SpectraBase Compound ID DmisesWgP6
InChI InChI=1S/C32H30B2N2O8/c37-19-28-29-30-31-32(40-29)44-34(39,43-31)21-8-6-14-36(16-21)18-27-24-11-3-1-9-22(24)26(23-10-2-4-12-25(23)27)17-35-13-5-7-20(15-35)33(38,41-28)42-30/h1-16,28-32,37-39H,17-19H2/t28-,29+,30-,31+,32+,33?,34?/m0/s1
InChIKey XBOHGSBHSGATBH-BPZHABKHSA-N
Mol Weight 592.2 g/mol
Molecular Formula C32H30B2N2O8
Exact Mass 592.218826 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8ED8GPyHudN
Name XBOHGSBHSGATBH-BPZHABKHSA-N
Compound Number 7-GLU
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H30B2N2O8
InChI InChI=1S/C32H30B2N2O8/c37-19-28-29-30-31-32(40-29)44-34(39,43-31)21-8-6-14-36(16-21)18-27-24-11-3-1-9-22(24)26(23-10-2-4-12-25(23)27)17-35-13-5-7-20(15-35)33(38,41-28)42-30/h1-16,28-32,37-39H,17-19H2/t28-,29+,30-,31+,32+,33?,34?/m0/s1
InChIKey XBOHGSBHSGATBH-BPZHABKHSA-N
Literature Reference Author H.EGGERT,J.FREDERIKSEN,C.MORIN,J.C.NORRILD
Literature Reference Citation J.ORG.CHEM.,64,3846(1999)
Literature Reference DOI 10.1021/jo9819279
Molecular Weight 592.219 g/mol
Sample ID 59216
Solvent D2O;PD=7.4