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4'-Dodec-10-ynyl-6-hex-4-ynyl-2-methoxy-4,2',6'-tris(4-methoxybenzyloxy)biphenyl
SpectraBase Compound ID LOLXpOqM0Gy
InChI InChI=1S/C55H64O7/c1-7-9-11-14-18-42(19-15-12-10-8-2)20-16-13-17-21-46-36-53(61-40-44-24-30-48(57-4)31-25-44)55(54(37-46)62-41-45-26-32-49(58-5)33-27-45)51-35-34-50(38-52(51)59-6)60-39-43-22-28-47(56-3)29-23-43/h22-38,42H,11-21,39-41H2,1-6H3
InChIKey PEMRDBFAMSDMBA-UHFFFAOYSA-N
Mol Weight 837.1 g/mol
Molecular Formula C55H64O7
Exact Mass 836.465204 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2YNUlK51JNJ
Name 4'-Dodec-10-ynyl-6-hex-4-ynyl-2-methoxy-4,2',6'-tris(4-methoxybenzyloxy)biphenyl
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C55H64O7
InChI InChI=1S/C55H64O7/c1-7-9-11-14-18-42(19-15-12-10-8-2)20-16-13-17-21-46-36-53(61-40-44-24-30-48(57-4)31-25-44)55(54(37-46)62-41-45-26-32-49(58-5)33-27-45)51-35-34-50(38-52(51)59-6)60-39-43-22-28-47(56-3)29-23-43/h22-38,42H,11-21,39-41H2,1-6H3
InChIKey PEMRDBFAMSDMBA-UHFFFAOYSA-N
Molecular Weight 837.110 g/mol
SMILES c1(c(OCc2ccc(cc2)OC)cc(cc1OCc1ccc(cc1)OC)CCCCCC(CCCC#CC)CCCC#CC)-c1c(cc(cc1)OCc1ccc(cc1)OC)OC
SPLASH splash10-00di-0900000100-be853d53bbe21d3d969f
Source of Spectrum QE-8-1867-31
Synonyms 5-[6-(hex-4-yn-1-yl)dodec-10-yn-1-yl]-2-{2-methoxy-4-[(4-methoxyphenyl)methoxy]phenyl}-1,3-bis[(4-methoxyphenyl)methoxy]benzene
Wiley ID 1557572