8,17-Dihexyl-6b,7,9,9a,15b,16,18,18a-octahydro-7,8 : 9,16-diepoxybenzo[1,2-k : 4,5-k']difluoranthene

SpectraBase Compound ID	5FAjd0bRv9p
InChI	InChI=1S/C46H46O2/c1-3-5-7-9-19-31-39-41(45-37-29-23-13-17-25-15-11-21-27(33(25)29)35(37)43(39)47-45)32(20-10-8-6-4-2)42-40(31)44-36-28-22-12-16-26-18-14-24-30(34(26)28)38(36)46(42)48-44/h11-18,21-24,35-38,43-46H,3-10,19-20H2,1-2H3/t35-,36+,37+,38?,43+,44+,45+,46-/m0/s1
InChIKey	FITKREHYRWZVHT-BWYJFUQZSA-N Google Search
Mol Weight	630.9 g/mol
Molecular Formula	C46H46O2
Exact Mass	630.349781 g/mol

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SpectraBase Spectrum ID	GcUR1jw2NA1
Name	8,17-Dihexyl-6b,7,9,9a,15b,16,18,18a-octahydro-7,8 : 9,16-diepoxybenzo[1,2-k : 4,5-k']difluoranthene
Alternate Name(s)	3,19-dihexyl-33,35-dioxaundecacyclo[19.11.1.1(5,17).1(7,11).1(23,27).0(2,20).0(4,18).0(6,16).0(15,36).0(22,32).0(31,34)]hexatriaconta-2(20),3,7,9,11(36),12,14,18,23(34),24,26,28,30-tridecaene
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C46H46O2
InChI	InChI=1S/C46H46O2/c1-3-5-7-9-19-31-39-41(45-37-29-23-13-17-25-15-11-21-27(33(25)29)35(37)43(39)47-45)32(20-10-8-6-4-2)42-40(31)44-36-28-22-12-16-26-18-14-24-30(34(26)28)38(36)46(42)48-44/h11-18,21-24,35-38,43-46H,3-10,19-20H2,1-2H3/t35-,36+,37+,38?,43+,44+,45+,46-/m0/s1
InChIKey	FITKREHYRWZVHT-BWYJFUQZSA-N
Molecular Weight	630.872 g/mol
SMILES	c12c([C@@]3(O[C@@]1([C@@]1([C@]3(c3cccc4c3c1ccc4)[H])[H])[H])[H])c(CCCCCC)c1c(c2CCCCCC)[C@]2([C@]3(C(c4cccc5c4c3ccc5)[C@@]1(O2)[H])[H])[H]
SPLASH	splash10-004i-0009200000-eb9450b5ae850c909f86
Source of Spectrum	K-126-2545-0
Wiley ID	1412134