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DICARBONYL-(ETA(5)-CYClOPENTADIENYL)-[EXO-3-[(1-3-ETA)-CYClOHEX-1-EN-4-YL]-PROPYLTHIOACETATE]-MOLYBDENUM
SpectraBase Compound ID 5lR9TTj2OcU
InChI InChI=1S/C11H17OS.C5H5.2CO.Mo/c1-10(12)13-9-5-8-11-6-3-2-4-7-11;1-2-4-5-3-1;2*1-2;/h2-3,6,11H,4-5,7-9H2,1H3;1-5H;;;/t11-;;;;/m1..../s1
InChIKey PLGDYBKKCYGCBS-LOSFGHDGSA-N
Mol Weight 414.38 g/mol
Molecular Formula C18H22MoO3S
Exact Mass 416.03437 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EexT74kZPWe
Name DICARBONYL-(ETA(5)-CYClOPENTADIENYL)-[EXO-3-[(1-3-ETA)-CYClOHEX-1-EN-4-YL]-PROPYLTHIOACETATE]-MOLYBDENUM
Compound Number 3D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H22MoO3S
InChI InChI=1S/C11H17OS.C5H5.2CO.Mo/c1-10(12)13-9-5-8-11-6-3-2-4-7-11;1-2-4-5-3-1;2*1-2;/h2-3,6,11H,4-5,7-9H2,1H3;1-5H;;;/t11-;;;;/m1..../s1
InChIKey PLGDYBKKCYGCBS-LOSFGHDGSA-N
Literature Reference Author M.C.P.YEH,C.N.CHAUNG
Literature Reference Citation J.CHEM.SOC.PERKIN-1,2167(1996)
Literature Reference DOI 10.1039/p19960002167
Molecular Weight 414.371 g/mol
Solvent CDCl3
Source File Reference UWSP10281