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PXNCISOJNQMMGJ-UHFFFAOYSA-N

View entire compound with spectra: 1 NMR

PXNCISOJNQMMGJ-UHFFFAOYSA-N
SpectraBase Compound ID AdISZKPfaoU
InChI InChI=1S/2C30H37.2C10H13.2Sn.2H/c2*1-19(2)25-14-10-15-26(20(3)4)29(25)23-12-9-13-24(18-23)30-27(21(5)6)16-11-17-28(30)22(7)8;2*1-8(2)10-6-4-9(3)5-7-10;;;;/h2*9-17,19-22H,1-8H3;2*4-8H,3H2,1-2H3;;;;
InChIKey PXNCISOJNQMMGJ-UHFFFAOYSA-N
Mol Weight 1299.1 g/mol
Molecular Formula C80H100Sn2
Exact Mass 1300.586907 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EfdDLobj3xu
Name PXNCISOJNQMMGJ-UHFFFAOYSA-N
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C80H100Sn2
InChI InChI=1S/2C30H37.2C10H13.2Sn.2H/c2*1-19(2)25-14-10-15-26(20(3)4)29(25)23-12-9-13-24(18-23)30-27(21(5)6)16-11-17-28(30)22(7)8;2*1-8(2)10-6-4-9(3)5-7-10;;;;/h2*9-17,19-22H,1-8H3;2*4-8H,3H2,1-2H3;;;;
InChIKey PXNCISOJNQMMGJ-UHFFFAOYSA-N
Literature Reference Author C.STANCIU,A.F.RICHARDS,P.P.POWER
Literature Reference Citation J.AM.CHEM.SOC.,126,4106(2004)
Literature Reference DOI 10.1021/ja0316871
Molecular Weight 1299.054 g/mol
Solvent C6D6
Source File Reference UWMZ24244