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Pentacarbonyl{[(1'R*,2'S*,3'S*)-2'-Methoxymethyl-3',6',6'-trimethyl-4'-oxocyclohexyl]methoxymethylene}tungsten(0)
SpectraBase Compound ID 4ntT7oLLJfd
InChI InChI=1S/C13H22O3.5CO.W/c1-9-10(7-15-4)11(8-16-5)13(2,3)6-12(9)14;5*1-2;/h9-11H,6-7H2,1-5H3;;;;;;/t9-,10-,11+;;;;;;/m0....../s1
InChIKey VSBUOAHYXPZDNK-DLIVBOEZSA-N
Mol Weight 550.21 g/mol
Molecular Formula C18H22O8W
Exact Mass 550.082401 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FsC665rMisw
Name Pentacarbonyl{[(1'R*,2'S*,3'S*)-2'-Methoxymethyl-3',6',6'-trimethyl-4'-oxocyclohexyl]methoxymethylene}tungsten(0)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22O8W
InChI InChI=1S/C13H22O3.5CO.W/c1-9-10(7-15-4)11(8-16-5)13(2,3)6-12(9)14;5*1-2;/h9-11H,6-7H2,1-5H3;;;;;;/t9-,10-,11+;;;;;;/m0....../s1
InChIKey VSBUOAHYXPZDNK-DLIVBOEZSA-N
Molecular Weight 550.207 g/mol
SMILES C(=[W](C#[O])(C#[O])(C#[O])(C#[O])C#[O])([C@]1(C(CC([C@]([C@@]1(COC)[H])(C)[H])=O)(C)C)[H])OC
SPLASH splash10-01ot-9060200000-4c82b6a012c3bdad2782
Source of Spectrum F-53-9334-9
Wiley ID 802929