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7-Oxabicyclo[2.2.1]heptane-2-carboxylic acid, 1,3,3-trimethyl-, ethyl ester
SpectraBase Compound ID LP40PepQmoZ
InChI InChI=1S/C12H20O3/c1-5-14-10(13)9-11(2,3)8-6-7-12(9,4)15-8/h8-9H,5-7H2,1-4H3
InChIKey TXSJAHQJEAKOIE-UHFFFAOYSA-N
Mol Weight 212.29 g/mol
Molecular Formula C12H20O3
Exact Mass 212.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GS2jyT833RL
Name 7-Oxabicyclo[2.2.1]heptane-2-carboxylic acid, 1,3,3-trimethyl-, ethyl ester
CAS Registry Number 70429-48-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O3
InChI InChI=1S/C12H20O3/c1-5-14-10(13)9-11(2,3)8-6-7-12(9,4)15-8/h8-9H,5-7H2,1-4H3
InChIKey TXSJAHQJEAKOIE-UHFFFAOYSA-N
Molecular Weight 212.289 g/mol
SMILES C12(C(C(C)(C)C(O2)CC1)C(=O)OCC)C
SPLASH splash10-0fzd-4900000000-23d18db6c35f5d3a3069
Source of Spectrum H-61-80-0
Synonyms 2,2,6-Trimethyl-3,6-epoxycyclohexanecarboxylic acid,ethylester Ethyl 1,3,3-trimethyl-7-oxabicyclo[2.2.1]heptane-2-carboxylate
Wiley ID 1211476