5,5-Dimethyl-2-[6'-butyl-2',2'-(dimethoxycarbonyl)-2',3'-dihydro-1'H-inden-5'-yl]-1,3,2-dioxaborinane

SpectraBase Compound ID	7wBmMiMZHL0
InChI	InChI=1S/C22H31BO6/c1-6-7-8-15-9-16-11-22(19(24)26-4,20(25)27-5)12-17(16)10-18(15)23-28-13-21(2,3)14-29-23/h9-10H,6-8,11-14H2,1-5H3
InChIKey	QIBZEMQZBYBMCO-UHFFFAOYSA-N Google Search
Mol Weight	402.3 g/mol
Molecular Formula	C22H31BO6
Exact Mass	402.221369 g/mol

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SpectraBase Spectrum ID	DR8mvs1YxVV
Name	5,5-Dimethyl-2-[6'-butyl-2',2'-(dimethoxycarbonyl)-2',3'-dihydro-1'H-inden-5'-yl]-1,3,2-dioxaborinane
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C22H31BO6
InChI	InChI=1S/C22H31BO6/c1-6-7-8-15-9-16-11-22(19(24)26-4,20(25)27-5)12-17(16)10-18(15)23-28-13-21(2,3)14-29-23/h9-10H,6-8,11-14H2,1-5H3
InChIKey	QIBZEMQZBYBMCO-UHFFFAOYSA-N
Molecular Weight	402.294 g/mol
SMILES	C1(Cc2cc(B3OCC(CO3)(C)C)c(cc2C1)CCCC)(C(=O)OC)C(=O)OC
SPLASH	splash10-0006-0029300000-c1c131b6b8dc073bc8b8
Source of Spectrum	F-62-4301-4
Synonyms	Dimethyl 5-butyl-6-(5,5-dimethyl-1,3,2-dioxaborinan-2-yl)-1,3-dihydro-2H-indene-2,2-dicarboxylate
Wiley ID	1633237