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5,5-Dimethylbicyclo[2.1.1]hexane-1-carboxylic acid
SpectraBase Compound ID LgtllNnG6fh
InChI InChI=1S/C9H14O2/c1-8(2)6-3-4-9(8,5-6)7(10)11/h6H,3-5H2,1-2H3,(H,10,11)
InChIKey CMISKJNMLQUXEF-UHFFFAOYSA-N
Mol Weight 154.21 g/mol
Molecular Formula C9H14O2
Exact Mass 154.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F8Skj2Ow5NX
Name 5,5-Dimethylbicyclo[2.1.1]hexane-1-carboxylic acid
CAS Registry Number 3753-38-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14O2
InChI InChI=1S/C9H14O2/c1-8(2)6-3-4-9(8,5-6)7(10)11/h6H,3-5H2,1-2H3,(H,10,11)
InChIKey CMISKJNMLQUXEF-UHFFFAOYSA-N
Molecular Weight 154.209 g/mol
SMILES OC(C12CCC(C2(C)C)C1)=O
SPLASH splash10-014l-9100000000-21ea1026677bbc0cdfd5
Synonyms 5,5-Dimethyl-4-bicyclo[2.1.1]hexanecarboxylic acid 5,5-Dimethylbicyclo[2.1.1]hexane-4-carboxylic acid Bicyclo[2.1.1]hexane-1-carboxylic acid, 5,5-dimethyl-
Wiley ID 1488761