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[N-(2,6-I-PR2-C6H3)-C(ME)-CHC-(ME)-N-(2,6-I-PR2-C6H3)-AL-(SH)2]
SpectraBase Compound ID 9mtMjocrm3n
InChI InChI=1S/C29H41N2.Al.2H2S/c1-18(2)24-13-11-14-25(19(3)4)28(24)30-22(9)17-23(10)31-29-26(20(5)6)15-12-16-27(29)21(7)8;;;/h11-21H,1-10H3;;2*1H2/q-1;+3;;/p-2/b22-17-,31-23?;;;
InChIKey LJSHEPGROIKZBG-COJGAKOWSA-L
Mol Weight 510.8 g/mol
Molecular Formula C29H43AlN2S2
Exact Mass 510.268305 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7B31eqwb8OG
Name [N-(2,6-I-PR2-C6H3)-C(ME)-CHC-(ME)-N-(2,6-I-PR2-C6H3)-AL-(SH)2]
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H43AlN2S2
InChI InChI=1S/C29H41N2.Al.2H2S/c1-18(2)24-13-11-14-25(19(3)4)28(24)30-22(9)17-23(10)31-29-26(20(5)6)15-12-16-27(29)21(7)8;;;/h11-21H,1-10H3;;2*1H2/q-1;+3;;/p-2/b22-17-,31-23?;;;
InChIKey LJSHEPGROIKZBG-COJGAKOWSA-L
Literature Reference Author V.JANCIK,Y.PENG,H.W.ROESKY,J.LI,D.NECULAI,A.M.NECULAI,R.HERB ST-IRMER
Literature Reference Citation J.AM.CHEM.SOC.,125,1452(2003)
Literature Reference DOI 10.1021/ja028801k
Molecular Weight 510.775 g/mol
Sample ID 40449
Solvent C6D6