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2,2-Dimethylcyclobutane-1-carboxylic acid
SpectraBase Compound ID 8XAvvsZm5gm
InChI InChI=1S/C7H12O2/c1-7(2)4-3-5(7)6(8)9/h5H,3-4H2,1-2H3,(H,8,9)
InChIKey WZUBYJLFSCGSNR-UHFFFAOYSA-N
Mol Weight 128.17 g/mol
Molecular Formula C7H12O2
Exact Mass 128.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F7tpNNhyW66
Name 2,2-Dimethylcyclobutane-1-carboxylic acid
CAS Registry Number 42836-66-8
Comments Less than 3 mono-isotopic peaks
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Formula C7H12O2
InChI InChI=1S/C7H12O2/c1-7(2)4-3-5(7)6(8)9/h5H,3-4H2,1-2H3,(H,8,9)
InChIKey WZUBYJLFSCGSNR-UHFFFAOYSA-N
Molecular Weight 128.171 g/mol
SMILES OC(C1CCC1(C)C)=O
SPLASH splash10-0udi-0900000000-3a5e5b4aa8dc387ed208
Source of Spectrum J-57-5618-19
Synonyms Cyclobutanecarboxylic acid, 2,2-dimethyl- 2,2-Dimethylcyclobutanecarboxylic acid 2,2-dimethyl-1-cyclobutanecarboxylic acid
Wiley ID 1131395