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bis[4'-(4"-Decyloxybenzoyl)-oxy]phenyl Tricyclo[8.2.2.2(4,7)]hexadeca-4,6,10,12,13,15-hexaene-5,11-dicarboxylate
SpectraBase Compound ID Qch9VpM3nv
InChI InChI=1S/C64H72O10/c1-3-5-7-9-11-13-15-17-43-69-53-31-27-51(28-32-53)61(65)71-55-35-39-57(40-36-55)73-63(67)59-45-47-19-23-49(59)25-21-48-20-24-50(26-22-47)60(46-48)64(68)74-58-41-37-56(38-42-58)72-62(66)52-29-33-54(34-30-52)70-44-18-16-14-12-10-8-6-4-2/h19-20,23-24,27-42,45-46H,3-18,21-22,25-26,43-44H2,1-2H3
InChIKey FWGMEIQPGRISEL-UHFFFAOYSA-N
Mol Weight 1001.3 g/mol
Molecular Formula C64H72O10
Exact Mass 1000.512549 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1VSzVRhfpPs
Name bis[4'-(4"-Decyloxybenzoyl)-oxy]phenyl Tricyclo[8.2.2.2(4,7)]hexadeca-4,6,10,12,13,15-hexaene-5,11-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C64H72O10
InChI InChI=1S/C64H72O10/c1-3-5-7-9-11-13-15-17-43-69-53-31-27-51(28-32-53)61(65)71-55-35-39-57(40-36-55)73-63(67)59-45-47-19-23-49(59)25-21-48-20-24-50(26-22-47)60(46-48)64(68)74-58-41-37-56(38-42-58)72-62(66)52-29-33-54(34-30-52)70-44-18-16-14-12-10-8-6-4-2/h19-20,23-24,27-42,45-46H,3-18,21-22,25-26,43-44H2,1-2H3
InChIKey FWGMEIQPGRISEL-UHFFFAOYSA-N
Molecular Weight 1001.270 g/mol
SMILES C(c1c2ccc(c1)CCc1c(C(Oc3ccc(OC(c4ccc(cc4)OCCCCCCCCCC)=O)cc3)=O)cc(CC2)cc1)(Oc1ccc(OC(c2ccc(cc2)OCCCCCCCCCC)=O)cc1)=O
SPLASH splash10-03e9-0090004000-669d18d97b4df8949ce8
Source of Spectrum H-85-440-0
Synonyms 5,11-bis(4-{[4-(decyloxy)phenyl]carbonyloxy}phenyl) tricyclo[8.2.2.2(4,7)]hexadeca-1(12),4,6,10,13,15-hexaene-5,11-dicarboxylate
Wiley ID 1523978