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Pentacarbonyl[1-((1R*,2S*,5R*)-menthyloxy)-trans-3-(4-methoxyphenyl)-2-propenylidene]chromium(0)
SpectraBase Compound ID DLzs9y1wL5o
InChI InChI=1S/C20H28O2.5CO.Cr/c1-15(2)19-12-7-16(3)14-20(19)22-13-5-6-17-8-10-18(21-4)11-9-17;5*1-2;/h5-6,8-11,15-16,19-20H,7,12,14H2,1-4H3;;;;;;/b6-5+;;;;;;/t16-,19+,20-;;;;;;/m0....../s1
InChIKey IGHXMINZABJCAU-GJIHOJDCSA-N
Mol Weight 492.49 g/mol
Molecular Formula C25H28CrO7
Exact Mass 492.124008 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1UDfyFzxWGI
Name Pentacarbonyl[1-((1R*,2S*,5R*)-menthyloxy)-trans-3-(4-methoxyphenyl)-2-propenylidene]chromium(0)
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 492.124008235 u
Formula C25H28CrO7
InChI InChI=1S/C20H28O2.5CO.Cr/c1-15(2)19-12-7-16(3)14-20(19)22-13-5-6-17-8-10-18(21-4)11-9-17;5*1-2;/h5-6,8-11,15-16,19-20H,7,12,14H2,1-4H3;;;;;;/b6-5+;;;;;;/t16-,19+,20-;;;;;;/m0....../s1
InChIKey IGHXMINZABJCAU-GJIHOJDCSA-N
Molecular Weight 492.488 g/mol
SMILES C(=[Cr](C#[O])(C#[O])(C#[O])(C#[O])C#[O])(O[C@@]1([C@](CC[C@@](C1)(C)[H])(C(C)C)[H])[H])\C=C\C=1C=CC(=CC1)OC