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2-(AZULEN-1-YL)-4,6-DIMETHYL-PYRANYLIUM-PERCHLORATE;(RN=H)
SpectraBase Compound ID 2r45iidPSL7
InChI InChI=1S/C17H15O.ClHO4/c1-12-10-13(2)18-17(11-12)16-9-8-14-6-4-3-5-7-15(14)16;2-1(3,4)5/h3-11H,1-2H3;(H,2,3,4,5)/q+1;/p-1
InChIKey GSDQFFIJKSFXFO-UHFFFAOYSA-M
Mol Weight 334.75 g/mol
Molecular Formula C17H15ClO5
Exact Mass 334.060801 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FhL7omvQ9mB
Name 2-(AZULEN-1-YL)-4,6-DIMETHYL-PYRANYLIUM-PERCHLORATE;(RN=H)
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H15ClO5
InChI InChI=1S/C17H15O.ClHO4/c1-12-10-13(2)18-17(11-12)16-9-8-14-6-4-3-5-7-15(14)16;2-1(3,4)5/h3-11H,1-2H3;(H,2,3,4,5)/q+1;/p-1
InChIKey GSDQFFIJKSFXFO-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 334.756 g/mol
Sample ID 67601
Solvent DMSO-D6