13,18,30,35-Tetraoxadibenzo[15,16:132,33]pentatetracontane-1,45-dial

SpectraBase Compound ID	6t0ZTWKdW3E
InChI	InChI=1S/C52H86O6/c53-39-29-19-13-7-1-3-9-15-21-31-41-55-45-49-35-25-27-37-51(49)47-57-43-33-23-17-11-5-6-12-18-24-34-44-58-48-52-38-28-26-36-50(52)46-56-42-32-22-16-10-4-2-8-14-20-30-40-54/h25-28,35-40H,1-24,29-34,41-48H2
InChIKey	SBLMWTROSLJGEN-UHFFFAOYSA-N Google Search
Mol Weight	807.3 g/mol
Molecular Formula	C52H86O6
Exact Mass	806.64244 g/mol

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SpectraBase Spectrum ID	1AgMY2jCBSI
Name	13,18,30,35-Tetraoxadibenzo[15,16:132,33]pentatetracontane-1,45-dial
Comments	Computed using HOSE algorithm
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	806.642440483 u
Formula	C52H86O6
InChI	InChI=1S/C52H86O6/c53-39-29-19-13-7-1-3-9-15-21-31-41-55-45-49-35-25-27-37-51(49)47-57-43-33-23-17-11-5-6-12-18-24-34-44-58-48-52-38-28-26-36-50(52)46-56-42-32-22-16-10-4-2-8-14-20-30-40-54/h25-28,35-40H,1-24,29-34,41-48H2
InChIKey	SBLMWTROSLJGEN-UHFFFAOYSA-N
Molecular Weight	807.254 g/mol
SMILES	C=1(C(COCCCCCCCCCCCC=O)=CC=CC1)COCCCCCCCCCCCCOCC=1C(COCCCCCCCCCCCC=O)=CC=CC1