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4-(3-METHYL-AZULEN-1-YL)-2,6-DIPHENYL-PYRANYLIUM-PERCHLORATE;(RN=R=H;X=ME)

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4-(3-METHYL-AZULEN-1-YL)-2,6-DIPHENYL-PYRANYLIUM-PERCHLORATE;(RN=R=H;X=ME)
SpectraBase Compound ID 6bp3TEFpVrE
InChI InChI=1S/C28H21O.ClHO4/c1-20-17-26(25-16-10-4-9-15-24(20)25)23-18-27(21-11-5-2-6-12-21)29-28(19-23)22-13-7-3-8-14-22;2-1(3,4)5/h2-19H,1H3;(H,2,3,4,5)/q+1;/p-1
InChIKey ULHRNKBQEOKZIY-UHFFFAOYSA-M
Mol Weight 472.92 g/mol
Molecular Formula C28H21ClO5
Exact Mass 472.107751 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DsUYUrqo3x1
Name 4-(3-METHYL-AZULEN-1-YL)-2,6-DIPHENYL-PYRANYLIUM-PERCHLORATE;(RN=R=H;X=ME)
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H21ClO5
InChI InChI=1S/C28H21O.ClHO4/c1-20-17-26(25-16-10-4-9-15-24(20)25)23-18-27(21-11-5-2-6-12-21)29-28(19-23)22-13-7-3-8-14-22;2-1(3,4)5/h2-19H,1H3;(H,2,3,4,5)/q+1;/p-1
InChIKey ULHRNKBQEOKZIY-UHFFFAOYSA-M
Literature Reference Author A.C.RAZUS,L.BIRZAN,C.PAVEL,O.LEHADUS,A.C.CORBU,C.ENACHE
Literature Reference Citation J.HETCYCL.CHEM.,43,963(2006)
Literature Reference DOI 10.1002/jhet.5570430423
Molecular Weight 472.925 g/mol
Sample ID 67571
Solvent ACETONE-D6