Bicyclo[2.1.1]hexane-1,4-dicarboxylic acid, 1,1-dimethylethyl methyl ester

SpectraBase Compound ID	JYYjHZ6Z8xY
InChI	InChI=1S/C13H20O4/c1-11(2,3)17-10(15)13-6-5-12(7-13,8-13)9(14)16-4/h5-8H2,1-4H3
InChIKey	QZNOHCGJYRZBCQ-UHFFFAOYSA-N Google Search
Mol Weight	240.3 g/mol
Molecular Formula	C13H20O4
Exact Mass	240.136159 g/mol

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SpectraBase Spectrum ID	Gb6pF4QomFn
Name	Bicyclo[2.1.1]hexane-1,4-dicarboxylic acid, 1,1-dimethylethyl methyl ester
CAS Registry Number	122699-62-1
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C13H20O4
InChI	InChI=1S/C13H20O4/c1-11(2,3)17-10(15)13-6-5-12(7-13,8-13)9(14)16-4/h5-8H2,1-4H3
InChIKey	QZNOHCGJYRZBCQ-UHFFFAOYSA-N
Molecular Weight	240.299 g/mol
SMILES	C12(C(OC(C)(C)C)=O)CC(C2)(C(=O)OC)CC1
SPLASH	splash10-0a4r-5900000000-3610256ccb469a4a1ebd
Source of Spectrum	J-54-4949-28
Synonyms	1-tert-Butyl 4-methyl bicyclo[2.1.1]hexane-1,4-dicarboxylate tert-Butyl 4-(methoxycarbonyl)bicyclo[2.1.1]hexane-1-carboxylate
Wiley ID	1242868