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Tricarbonyl { benzyl-tris[ (benzyl)( phenyl)phosphanylmethyl]methane}molybdenium
SpectraBase Compound ID I7ijEds16ET
InChI InChI=1S/C50H49P3.3CO.Mo/c1-8-22-43(23-9-1)36-50(40-51(47-30-16-5-17-31-47)37-44-24-10-2-11-25-44,41-52(48-32-18-6-19-33-48)38-45-26-12-3-13-27-45)42-53(49-34-20-7-21-35-49)39-46-28-14-4-15-29-46;3*1-2;/h1-35H,36-42H2;;;;
InChIKey MTOKIPLQPAXFEE-UHFFFAOYSA-N
Mol Weight 922.8 g/mol
Molecular Formula C53H49MoO3P3
Exact Mass 924.19486 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DapPfDFr2gD
Name Tricarbonyl { benzyl-tris[ (benzyl)( phenyl)phosphanylmethyl]methane}molybdenium
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C53H49MoO3P3
InChI InChI=1S/C50H49P3.3CO.Mo/c1-8-22-43(23-9-1)36-50(40-51(47-30-16-5-17-31-47)37-44-24-10-2-11-25-44,41-52(48-32-18-6-19-33-48)38-45-26-12-3-13-27-45)42-53(49-34-20-7-21-35-49)39-46-28-14-4-15-29-46;3*1-2;/h1-35H,36-42H2;;;;
InChIKey MTOKIPLQPAXFEE-UHFFFAOYSA-N
Molecular Weight 922.844 g/mol
SMILES C1[P-]([Mo+3]2([P-](CC1(Cc1ccccc1)C[P-]2(Cc1ccccc1)c1ccccc1)(Cc1ccccc1)c1ccccc1)(C#[O])(C#[O])C#[O])(Cc1ccccc1)c1ccccc1
SPLASH splash10-00r2-0000000696-7d84d93f4bd72d492517
Source of Spectrum K-130-1390-5
Synonyms 2,4,6,7-tetrabenzyl-1,1,1-tris(hydroxymethyl)-2,6,7-triphenyl-2,6,7-triphospha-1-molybdabicyclo[2.2.2]octane-1,1,1-tris(ylium)-2,6,7-triuide
Wiley ID 1418153