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(Biscyclopentadienylzirconium)(diphenylethenyl)(.mu.-hydro)(9-borabicyclo[4.2.1]nonane) complex
SpectraBase Compound ID IYX5sqDSg1A
InChI InChI=1S/C22H25B.2C5H5.Zr/c1-3-9-18(10-4-1)17-22(19-11-5-2-6-12-19)23-20-13-7-8-14-21(23)16-15-20;2*1-2-4-5-3-1;/h1-6,9-12,20-21,23H,7-8,13-16H2;2*1-5H;/t20-,21+;;;
InChIKey YWQBUCFWSLYWLK-UHWYODDOSA-N
Mol Weight 521.7 g/mol
Molecular Formula C32H35BZr
Exact Mass 520.18788 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L9STfbC4Kv5
Name (Biscyclopentadienylzirconium)(diphenylethenyl)(.mu.-hydro)(9-borabicyclo[4.2.1]nonane) complex
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H35BZr
InChI InChI=1S/C22H25B.2C5H5.Zr/c1-3-9-18(10-4-1)17-22(19-11-5-2-6-12-19)23-20-13-7-8-14-21(23)16-15-20;2*1-2-4-5-3-1;/h1-6,9-12,20-21,23H,7-8,13-16H2;2*1-5H;/t20-,21+;;;
InChIKey YWQBUCFWSLYWLK-UHWYODDOSA-N
Molecular Weight 521.666 g/mol
SMILES [C]1=2([Zr]3456789%10(C2c2ccccc2)([H][B]11[C@@]2(CC[C@]1(CCCC2)[H])[H])([C@]1([C@@]6([C@@]7([C@@]8([C@@]91[H])[H])[H])[H])[H])[C@]1([C@@]%10([C@@]5([C@@]4([C@@]31[H])[H])[H])[H])[H])c1ccccc1
SPLASH splash10-00b9-0961000000-7d6a615acdaf85d5395d
Source of Spectrum F-51-4288-10
Wiley ID 791604