1,5-bis[4-(8'-Methoxycarbonyl-2'-anthryl)butyl]2,5-dimethoxybenzene

SpectraBase Compound ID	BKaRVTx7Dpb
InChI	InChI=1S/C48H46O6/c1-51-45-29-38(14-8-6-12-32-20-22-34-26-36-16-10-18-42(48(50)54-4)44(36)28-40(34)24-32)46(52-2)30-37(45)13-7-5-11-31-19-21-33-25-35-15-9-17-41(47(49)53-3)43(35)27-39(33)23-31/h9-10,15-30H,5-8,11-14H2,1-4H3
InChIKey	QOJOJORTIWCWFX-UHFFFAOYSA-N Google Search
Mol Weight	718.9 g/mol
Molecular Formula	C48H46O6
Exact Mass	718.329439 g/mol

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SpectraBase Spectrum ID	Tl86mhBjSI
Name	1,5-bis[4-(8'-Methoxycarbonyl-2'-anthryl)butyl]2,5-dimethoxybenzene
Comments	Computed using HOSE algorithm
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	718.329439195 u
Formula	C48H46O6
InChI	InChI=1S/C48H46O6/c1-51-45-29-38(14-8-6-12-32-20-22-34-26-36-16-10-18-42(48(50)54-4)44(36)28-40(34)24-32)46(52-2)30-37(45)13-7-5-11-31-19-21-33-25-35-15-9-17-41(47(49)53-3)43(35)27-39(33)23-31/h9-10,15-30H,5-8,11-14H2,1-4H3
InChIKey	QOJOJORTIWCWFX-UHFFFAOYSA-N
Molecular Weight	718.890 g/mol
SMILES	C=12C(C(=O)OC)=CC=CC2=CC2=CC=C(C=C2C1)CCCCC=1C(=CC(=C(C1)OC)CCCCC=1C=C2C=C3C(C(=O)OC)=CC=CC3=CC2=CC1)OC