4,7,12,15-Tetra( p-methoxystyryl) [2.2] paracyclophane

SpectraBase Compound ID	DOH950dE3Jn
InChI	InChI=1S/C52H48O4/c1-53-49-25-9-37(10-26-49)5-17-41-33-46-23-24-48-36-43(19-7-39-13-29-51(55-3)30-14-39)47(35-44(48)20-8-40-15-31-52(56-4)32-16-40)22-21-45(41)34-42(46)18-6-38-11-27-50(54-2)28-12-38/h5-20,25-36H,21-24H2,1-4H3/b17-5+,18-6+,19-7+,20-8+
InChIKey	LUYNZLZJOYFVFB-MVXDNDCSSA-N Google Search
Mol Weight	737.0 g/mol
Molecular Formula	C52H48O4
Exact Mass	736.35526 g/mol

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SpectraBase Spectrum ID	5wFrgR9EAYE
Name	4,7,12,15-Tetra( p-methoxystyryl) [2.2] paracyclophane
Comments	Computed using HOSE algorithm
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	736.355260022 u
Formula	C52H48O4
InChI	InChI=1S/C52H48O4/c1-53-49-25-9-37(10-26-49)5-17-41-33-46-23-24-48-36-43(19-7-39-13-29-51(55-3)30-14-39)47(35-44(48)20-8-40-15-31-52(56-4)32-16-40)22-21-45(41)34-42(46)18-6-38-11-27-50(54-2)28-12-38/h5-20,25-36H,21-24H2,1-4H3/b17-5+,18-6+,19-7+,20-8+
InChIKey	LUYNZLZJOYFVFB-MVXDNDCSSA-N
Molecular Weight	736.952 g/mol
SMILES	C1(\C=C\C=2C=CC(=CC2)OC)=C2C=C(C(=C1)CCC=1C(\C=C\C3=CC=C(C=C3)OC)=CC(=C(\C=C\C3=CC=C(C=C3)OC)C1)CC2)\C=C\C1=CC=C(C=C1)OC