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Bicyclo[2.1.1]hexane-1-carboxylic acid, 4-methyl-, 1,1-dimethylethyl ester
SpectraBase Compound ID 226MdylQF05
InChI InChI=1S/C12H20O2/c1-10(2,3)14-9(13)12-6-5-11(4,7-12)8-12/h5-8H2,1-4H3
InChIKey DZGSMAQFUXNFOZ-UHFFFAOYSA-N
Mol Weight 196.29 g/mol
Molecular Formula C12H20O2
Exact Mass 196.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IE4QVN8gFGu
Name Bicyclo[2.1.1]hexane-1-carboxylic acid, 4-methyl-, 1,1-dimethylethyl ester
CAS Registry Number 122699-70-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O2
InChI InChI=1S/C12H20O2/c1-10(2,3)14-9(13)12-6-5-11(4,7-12)8-12/h5-8H2,1-4H3
InChIKey DZGSMAQFUXNFOZ-UHFFFAOYSA-N
Molecular Weight 196.290 g/mol
SMILES C12(C(OC(C)(C)C)=O)CC(C2)(C)CC1
SPLASH splash10-05c5-9300000000-09c1d9f654a9ddc87be7
Source of Spectrum J-54-4949-31
Synonyms tert-Butyl 4-methylbicyclo[2.1.1]hexane-1-carboxylate
Wiley ID 1193624