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LSNMXBRRSNHNJM-FPTAEVAOSA-M

View entire compound with spectra: 1 NMR

LSNMXBRRSNHNJM-FPTAEVAOSA-M
SpectraBase Compound ID 7SMuK0o9S23
InChI InChI=1S/2C9H11.C6H6.C5H5N.C5H.C5.CHF3O3S.Fe.Sn/c2*1-7-4-8(2)6-9(3)5-7;2*1-2-4-6-5-3-1;2*1-2-4-5-3-1;2-1(3,4)8(5,6)7;;/h2*4-5H,1-3H3;1-6H;1-5H;1H;;(H,5,6,7);;/q;;;;;;;;+1/p-1/i;;1D,2D,3D,4D,5D,6D;;;;;;
InChIKey LSNMXBRRSNHNJM-FPTAEVAOSA-M
Mol Weight 846.4 g/mol
Molecular Formula C40H282H6F3FeNO3SSn
Exact Mass 847.095948 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EwxkUGY5DwS
Name LSNMXBRRSNHNJM-FPTAEVAOSA-M
Compound Number 12*C6D6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H282H6F3FeNO3SSn
InChI InChI=1S/2C9H11.C6H6.C5H5N.C5H.C5.CHF3O3S.Fe.Sn/c2*1-7-4-8(2)6-9(3)5-7;2*1-2-4-6-5-3-1;2*1-2-4-5-3-1;2-1(3,4)8(5,6)7;;/h2*4-5H,1-3H3;1-6H;1-5H;1H;;(H,5,6,7);;/q;;;;;;;;+1/p-1/i;;1D,2D,3D,4D,5D,6D;;;;;;
InChIKey LSNMXBRRSNHNJM-FPTAEVAOSA-M
Literature Reference Author T.BAUMGARTNER,F.JAEKLE,R.RULKENS,G.ZECH,A.J.LOUGH,I.MANNERS
Literature Reference Citation J.AM.CHEM.SOC.,124,10062(2002)
Literature Reference DOI 10.1021/ja020206v
Molecular Weight 846.344 g/mol
Sample ID 34880
Solvent C6D6