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Pentacarbonyl{ 3-(4'-methoxyphenyl)-1-[8'-phenylmenthyloxy]-2-propenylidene}chromium ( 0 )
SpectraBase Compound ID 9U5M4HHxAUO
InChI InChI=1S/C26H32O2.5CO.Cr/c1-20-12-17-24(26(2,3)22-10-6-5-7-11-22)25(19-20)28-18-8-9-21-13-15-23(27-4)16-14-21;5*1-2;/h5-11,13-16,20,24-25H,12,17,19H2,1-4H3;;;;;;/b9-8+;;;;;;
InChIKey UHBAYKOXYLWNFG-HPBBOWEFSA-N
Mol Weight 568.6 g/mol
Molecular Formula C31H32CrO7
Exact Mass 568.155308 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CeZ7Ura4gBi
Name Pentacarbonyl{ 3-(4'-methoxyphenyl)-1-[8'-phenylmenthyloxy]-2-propenylidene}chromium ( 0 )
Comments Computed using HOSE algorithm
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Exact Mass 568.155308363 u
Formula C31H32CrO7
InChI InChI=1S/C26H32O2.5CO.Cr/c1-20-12-17-24(26(2,3)22-10-6-5-7-11-22)25(19-20)28-18-8-9-21-13-15-23(27-4)16-14-21;5*1-2;/h5-11,13-16,20,24-25H,12,17,19H2,1-4H3;;;;;;/b9-8+;;;;;;
InChIKey UHBAYKOXYLWNFG-HPBBOWEFSA-N
Molecular Weight 568.586 g/mol
SMILES C(=[Cr](C#[O])(C#[O])(C#[O])(C#[O])C#[O])(OC1C(C(C2=CC=CC=C2)(C)C)CCC(C1)C)\C=C\C=1C=CC(=CC1)OC