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Bicyclo[1.1.1]pentane-1-carboxylic acid, 3-(1,1-dimethylethoxy)-, methyl ester
SpectraBase Compound ID Ix1uvhVNJWl
InChI InChI=1S/C11H18O3/c1-9(2,3)14-11-5-10(6-11,7-11)8(12)13-4/h5-7H2,1-4H3
InChIKey ZFKDATVQTZKSHX-UHFFFAOYSA-N
Mol Weight 198.26 g/mol
Molecular Formula C11H18O3
Exact Mass 198.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KOoyDCOlm8O
Name Bicyclo[1.1.1]pentane-1-carboxylic acid, 3-(1,1-dimethylethoxy)-, methyl ester
CAS Registry Number 131515-45-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18O3
InChI InChI=1S/C11H18O3/c1-9(2,3)14-11-5-10(6-11,7-11)8(12)13-4/h5-7H2,1-4H3
InChIKey ZFKDATVQTZKSHX-UHFFFAOYSA-N
Molecular Weight 198.262 g/mol
SMILES C12(C(=O)OC)CC(C2)(OC(C)(C)C)C1
SPLASH splash10-0a4l-9000000000-166a60198d6640156d53
Source of Spectrum J-56-316-33
Synonyms Methyl 3-tert-butoxybicyclo[1.1.1]pentane-1-carboxylate
Wiley ID 1195564