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Molybdenum, dicarbonyl-bis(hapto-4-R(+)-pulegone)

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Molybdenum, dicarbonyl-bis(hapto-4-R(+)-pulegone)
SpectraBase Compound ID 9mWO8octEvv
InChI InChI=1S/2C7H16.2C3H8.2CO.Mo/c2*1-4-6-7(3)5-2;2*1-3-2;2*1-2;/h2*7H,4-6H2,1-3H3;2*3H2,1-2H3;;;/q;;;;2*-1;
InChIKey KBNLWCBRAGIOCM-UHFFFAOYSA-N
Mol Weight 440.57 g/mol
Molecular Formula C22H48MoO2
Exact Mass 442.270835 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID y0NYUxgS5F
Name Molybdenum, dicarbonyl-bis(hapto-4-R(+)-pulegone)
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 442.270834784 u
Formula C22H48MoO2
InChI InChI=1S/2C7H16.2C3H8.2CO.Mo/c2*1-4-6-7(3)5-2;2*1-3-2;2*1-2;/h2*7H,4-6H2,1-3H3;2*3H2,1-2H3;;;/q;;;;2*-1;
InChIKey KBNLWCBRAGIOCM-UHFFFAOYSA-N
Molecular Weight 440.575 g/mol
Nominal Mass 442 u
SMILES [C-]([Mo][C-]=O)=O.C(CC(CC)C)C.C(C)C.CCC(C)CCC.C(C)C