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Pentacarbonyl-{1-[N-cyclohexylamino]-1-phenyl-3-methoxyprop-1-enylidene}-tungsten
SpectraBase Compound ID 3R81FGANMB7
InChI InChI=1S/C16H21NO.5CO.W/c1-18-13-12-16(14-8-4-2-5-9-14)17-15-10-6-3-7-11-15;5*1-2;/h2,4-5,8-9,12,15,17H,3,6-7,10-11H2,1H3;;;;;;/b16-12-;;;;;;
InChIKey CENMKBQNCAALQI-IWMCFYKNSA-N
Mol Weight 567.24 g/mol
Molecular Formula C21H21NO6W
Exact Mass 567.08782 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KCS1LSgtdbU
Name Pentacarbonyl-{1-[N-cyclohexylamino]-1-phenyl-3-methoxyprop-1-enylidene}-tungsten
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 567.087820394 u
Formula C21H21NO6W
InChI InChI=1S/C16H21NO.5CO.W/c1-18-13-12-16(14-8-4-2-5-9-14)17-15-10-6-3-7-11-15;5*1-2;/h2,4-5,8-9,12,15,17H,3,6-7,10-11H2,1H3;;;;;;/b16-12-;;;;;;
InChIKey CENMKBQNCAALQI-IWMCFYKNSA-N
Molecular Weight 567.241 g/mol
SMILES C(=[W](C#[O])(C#[O])(C#[O])(C#[O])C#[O])(\C=C\(NC1CCCCC1)C=1C=CC=CC1)OC