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Tetracyclo[11.2.0.0(3,6).0(8,11)]pentadecane-2,7,12-trione, 4,5,9,10,14,15-hexaphenyl-
SpectraBase Compound ID JgZwtJeWiML
InChI InChI=1S/C51H42O3/c52-49-43-37(31-19-7-1-8-20-31)38(32-21-9-2-10-22-32)44(43)50(53)47-41(35-27-15-5-16-28-35)42(36-29-17-6-18-30-36)48(47)51(54)46-40(34-25-13-4-14-26-34)39(45(46)49)33-23-11-3-12-24-33/h1-30,37-48H
InChIKey VPGXGGFGZGTIAB-UHFFFAOYSA-N
Mol Weight 702.9 g/mol
Molecular Formula C51H42O3
Exact Mass 702.313395 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FREVU72ivCZ
Name Tetracyclo[11.2.0.0(3,6).0(8,11)]pentadecane-2,7,12-trione, 4,5,9,10,14,15-hexaphenyl-
Alternate Name(s) 1,2,4,5,7,8-Hexaphenyl-tri(cyclobuta)[a.d.g]nonane-3,6,9-trione 4,5,9,10,14,15-hexaphenyltetracyclo[11.2.0.0(3,6).0(8,11)]pentadecane-2,7,12-trione
CAS Registry Number 61539-53-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C51H42O3
InChI InChI=1S/C51H42O3/c52-49-43-37(31-19-7-1-8-20-31)38(32-21-9-2-10-22-32)44(43)50(53)47-41(35-27-15-5-16-28-35)42(36-29-17-6-18-30-36)48(47)51(54)46-40(34-25-13-4-14-26-34)39(45(46)49)33-23-11-3-12-24-33/h1-30,37-48H
InChIKey VPGXGGFGZGTIAB-UHFFFAOYSA-N
Molecular Weight 702.894 g/mol
SMILES C12C(C(C3C(C(C4C(C2=O)C(C4c2ccccc2)c2ccccc2)=O)C(C3c2ccccc2)c2ccccc2)=O)C(C1c1ccccc1)c1ccccc1
SPLASH splash10-001i-1931000000-031041913ac24451dbb2
Source of Spectrum KC-1976-1886-0
Wiley ID 1415125