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4,7,12,15-TETRASTYRYL-[2.2]-p-CYCLOPHANE-TETRAMETHYL-DERIVATIVE-POTASSIUM-SALT
SpectraBase Compound ID JNJDvENGzGc
InChI InChI=1S/C52H44.4K/c1-37-13-5-9-17-41(37)21-25-45-33-50-31-32-52-36-47(27-23-43-19-11-7-15-39(43)3)51(35-48(52)28-24-44-20-12-8-16-40(44)4)30-29-49(45)34-46(50)26-22-42-18-10-6-14-38(42)2;;;;/h5-20,25-28,33-36H,29-32H2,1-4H3;;;;/q-4;4*+1
InChIKey CAWIPCCAAUXGEV-UHFFFAOYSA-N
Mol Weight 825.3172 g/mol
Molecular Formula C52H44K4
Exact Mass 824.199127 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EHeFLNGgRfk
Name 4,7,12,15-TETRASTYRYL-[2.2]-p-CYCLOPHANE-TETRAMETHYL-DERIVATIVE-POTASSIUM-SALT
Compound Number 2(4-)/4K+
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C52H44.4K/c1-37-13-5-9-17-41(37)21-25-45-33-50-31-32-52-36-47(27-23-43-19-11-7-15-39(43)3)51(35-48(52)28-24-44-20-12-8-16-40(44)4)30-29-49(45)34-46(50)26-22-42-18-10-6-14-38(42)2;;;;/h5-20,25-28,33-36H,29-32H2,1-4H3;;;;/q-4;4*+1
InChIKey CAWIPCCAAUXGEV-UHFFFAOYSA-N
Literature Reference E.SHABTAI,M.RABINOVITZ,B.KOENIG,B.KNIERIEM,A.DEMEIJERE J.CHEM.SOC.PERKIN-2,2589(1996)
Solvent Tetrahydrofuran-d8
Technique SELECTIVE DECOUPLING; C/H SHIFT CORRELATION