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4-(AZULEN-1-YL)-2,6-DIPHENYL-3-METHYL-PYRANYLIUM-PERCHLORATE;(RN=X=H,R=ME)
SpectraBase Compound ID 52WhEqeeAAH
InChI InChI=1S/C28H21O.ClHO4/c1-20-26(25-18-17-21-11-5-4-10-16-24(21)25)19-27(22-12-6-2-7-13-22)29-28(20)23-14-8-3-9-15-23;2-1(3,4)5/h2-19H,1H3;(H,2,3,4,5)/q+1;/p-1
InChIKey PBOMTGCTGHYBRX-UHFFFAOYSA-M
Mol Weight 472.92 g/mol
Molecular Formula C28H21ClO5
Exact Mass 472.107751 g/mol
Parent InChIKey LWUJJDVLAKEMNQ-UHFFFAOYSA-M
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