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1,6,12,17,23,28-HEXASELENACYCLOTRITRIACONTA-2,4,13,15,24,26-HEXAYNE
SpectraBase Compound ID ai9YbQy3AA
InChI InChI=1S/C27H30Se6/c1-4-16-28-22-10-12-24-30-18-6-2-8-20-32-26-14-15-27-33-21-9-3-7-19-31-25-13-11-23-29-17-5-1/h1-9,16-21H2
InChIKey PCTGEWHVTWMBEI-UHFFFAOYSA-N
Mol Weight 828.37 g/mol
Molecular Formula C27H30Se6
Exact Mass 833.733883 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 79wvU4QwdFa
Name 1,6,12,17,23,28-HEXASELENACYCLOTRITRIACONTA-2,4,13,15,24,26-HEXAYNE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H30Se6
InChI InChI=1S/C27H30Se6/c1-4-16-28-22-10-12-24-30-18-6-2-8-20-32-26-14-15-27-33-21-9-3-7-19-31-25-13-11-23-29-17-5-1/h1-9,16-21H2
InChIKey PCTGEWHVTWMBEI-UHFFFAOYSA-N
Literature Reference Author D.B.WERZ,R.GLEITER,F.ROMINGER
Literature Reference Citation J.AM.CHEM.SOC.,124,10638(2002)
Literature Reference DOI 10.1021/ja027146d
Molecular Weight 828.295 g/mol
Sample ID 34752
Solvent DMSO-D6