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2-[4-dec-8-ynyl-2,6-bis(p-anisyloxy)phenyl]-1-methoxy-3-oct-6-ynyl-5-p-anisyloxy-benzene
SpectraBase Compound ID 2thS85DLAtZ
InChI InChI=1S/C55H64O7/c1-7-9-11-13-15-16-17-19-21-45-35-52(61-40-43-25-31-48(57-4)32-26-43)55(53(36-45)62-41-44-27-33-49(58-5)34-28-44)54-46(22-20-18-14-12-10-8-2)37-50(38-51(54)59-6)60-39-42-23-29-47(56-3)30-24-42/h23-38H,11-22,39-41H2,1-6H3
InChIKey QICTXHMHDFUBSD-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 1stEM6KOm5I
Name 2-[4-dec-8-ynyl-2,6-bis(p-anisyloxy)phenyl]-1-methoxy-3-oct-6-ynyl-5-p-anisyloxy-benzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C55H64O7
InChI InChI=1S/C55H64O7/c1-7-9-11-13-15-16-17-19-21-45-35-52(61-40-43-25-31-48(57-4)32-26-43)55(53(36-45)62-41-44-27-33-49(58-5)34-28-44)54-46(22-20-18-14-12-10-8-2)37-50(38-51(54)59-6)60-39-42-23-29-47(56-3)30-24-42/h23-38H,11-22,39-41H2,1-6H3
InChIKey QICTXHMHDFUBSD-UHFFFAOYSA-N
Molecular Weight 837.110 g/mol
SMILES c1(c(cc(cc1CCCCCC#CC)OCc1ccc(cc1)OC)OC)-c1c(cc(cc1OCc1ccc(cc1)OC)CCCCCCCC#CC)OCc1ccc(cc1)OC
SPLASH splash10-00di-0900000200-8710ee47dee9cf4cb063
Source of Spectrum QE-8-1867-32
Synonyms 2-[4-dec-8-ynyl-2,6-bis[(4-methoxyphenyl)methoxy]phenyl]-1-methoxy-5-[(4-methoxyphenyl)methoxy]-3-oct-6-ynyl-benzene
Wiley ID 1557571