1,2,4-Metheno-1H-cyclobuta[cd]pentalene, 1,3-dioxane-4,6-dione deriv.

SpectraBase Compound ID	7aIlot8vIft
InChI	InChI=1S/C22H20O8/c1-21(2)27-17(23)15(18(24)28-21)13-9-5-6-7(9)12-11(13)8(5)10(6)14(12)16-19(25)29-22(3,4)30-20(16)26/h5-12H,1-4H3/t5-,6-,7-,8-,9+,10+,11-,12-/m0/s1
InChIKey	HGJQOXALDHRAOO-MCODLXCSSA-N Google Search
Mol Weight	412.39 g/mol
Molecular Formula	C22H20O8
Exact Mass	412.115818 g/mol

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SpectraBase Spectrum ID	GZOq33Aw2ky
Name	1,2,4-Metheno-1H-cyclobuta[cd]pentalene, 1,3-dioxane-4,6-dione deriv.
Alternate Name(s)	1,3-Dioxane-4,6-dione, 5,5'-(hexahydro-1,2,4-metheno-1H-cyclobuta[cd]pentalene-3,5-diylidene)bis[2,2-dimethyl- 5,5'-Pentacyclo[5.3.0.0(2,6).0(4,10).0(5,8)]decane-3'',9''-diylidene)-bis(2,2-dimethyl-1,3-dioxan-4,6-dione) 5-[10-(2,2-dimethyl-4,6-dioxo-1,3-dioxan-5-ylidene)pentacyclo[5.3.0.0(2,5).0(3,9).0(4,8)]dec-6-ylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione
CAS Registry Number	106898-08-2
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C22H20O8
InChI	InChI=1S/C22H20O8/c1-21(2)27-17(23)15(18(24)28-21)13-9-5-6-7(9)12-11(13)8(5)10(6)14(12)16-19(25)29-22(3,4)30-20(16)26/h5-12H,1-4H3/t5-,6-,7-,8-,9+,10+,11-,12-/m0/s1
InChIKey	HGJQOXALDHRAOO-MCODLXCSSA-N
Molecular Weight	412.394 g/mol
SMILES	C1(=C2[C@@]3([C@]4(C(=C5C(OC(OC5=O)(C)C)=O)[C@]5([C@@]3([C@@]3([C@]5([C@]4([C@]23[H])[H])[H])[H])[H])[H])[H])[H])C(OC(OC1=O)(C)C)=O
SPLASH	splash10-0002-2690000000-491f0897378c5566335c
Source of Spectrum	B-42-1342-27
Wiley ID	1374383