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OUWKUTUFALPKNW-UHFFFAOYSA-N

View entire compound with spectra: 2 NMR

OUWKUTUFALPKNW-UHFFFAOYSA-N
SpectraBase Compound ID Do9OaoRlzI6
InChI InChI=1S/3C12H18N.2C8H16O4.C7H6P.Mo.2Na/c3*1-9-6-10(2)8-11(7-9)13-12(3,4)5;2*1-2-10-5-6-12-8-7-11-4-3-9-1;1-8-7-5-3-2-4-6-7;;;/h3*6-8H,1-5H3;2*1-8H2;2-6,8H;;;/q3*-1;;;;+3;;
InChIKey OUWKUTUFALPKNW-UHFFFAOYSA-N
Mol Weight 1144.3 g/mol
Molecular Formula C59H92MoN3Na2O8P
Exact Mass 1145.547146 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IA5rXG7InG9
Name OUWKUTUFALPKNW-UHFFFAOYSA-N
Compound Number 1-CPPHNA(12-CROWN-4)2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C59H91MoN3Na2O8P
InChI InChI=1S/3C12H18N.2C8H16O4.C7H6P.Mo.2Na/c3*1-9-6-10(2)8-11(7-9)13-12(3,4)5;2*1-2-10-5-6-12-8-7-11-4-3-9-1;1-8-7-5-3-2-4-6-7;;;/h3*6-8H,1-5H3;2*1-8H2;2-6,8H;;;/q3*-1;;;;+3;;
InChIKey OUWKUTUFALPKNW-UHFFFAOYSA-N
Literature Reference Author T.AGAPIE,P.L.DIACONESCU,C.C.CUMMINS
Literature Reference Citation J.AM.CHEM.SOC.,124,2412(2002)
Literature Reference DOI 10.1021/ja017278r
Molecular Weight 1143.280 g/mol
Sample ID 47858
Solvent THF-D8