For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
MAJOR-ISOMER
SpectraBase Compound ID IUaSB9Yaqx
InChI InChI=1S/C24H20B.C17H16.CH3.Zr/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24;1-17(2,14-8-4-5-9-14)16-12-11-13-7-3-6-10-15(13)16;;/h1-20H;3-12H,1-2H3;1H3;/q-1;;;+1
InChIKey XPBRNUQPQZRDTM-UHFFFAOYSA-N
Mol Weight 645.81 g/mol
Molecular Formula C42H39BZr
Exact Mass 644.21918 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID J9dE70eNY8O
Name MAJOR-ISOMER
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H39BZr
InChI InChI=1S/C24H20B.C17H16.CH3.Zr/c1-5-13-21(14-6-1)25(22-15-7-2-8-16-22,23-17-9-3-10-18-23)24-19-11-4-12-20-24;1-17(2,14-8-4-5-9-14)16-12-11-13-7-3-6-10-15(13)16;;/h1-20H;3-12H,1-2H3;1H3;/q-1;;;+1
InChIKey XPBRNUQPQZRDTM-UHFFFAOYSA-N
Literature Reference Author J.W.STRAUCH,J.L.FAURE,S.BREDEAU,C.WANG,G.KEHR,R.FROEHLICH,H. LUFTMANN,G.ERKER
Literature Reference Citation J.AM.CHEM.SOC.,126,2089(2004)
Literature Reference DOI 10.1021/ja035739y
Molecular Weight 645.802 g/mol
Solvent DICHLOROMETHANE-D2
Source File Reference UWVN31921