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1,2-Dihydroxy-α,α-dimethyl-6-(hydroxymethyl)cyclohexaneacetic acid, β-lactone
SpectraBase Compound ID 6gmr1J74mWg
InChI InChI=1S/C11H18O4/c1-10(2)9(14)15-11(10)7(6-12)4-3-5-8(11)13/h7-8,12-13H,3-6H2,1-2H3
InChIKey ARLFQIJJRIPDIZ-UHFFFAOYSA-N
Mol Weight 214.26 g/mol
Molecular Formula C11H18O4
Exact Mass 214.120509 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IxFv8VRDOki
Name 1,2-Dihydroxy-α,α-dimethyl-6-(hydroxymethyl)cyclohexaneacetic acid, β-lactone
Source of Sample J. Falbe, Shell Grundlagenforschung, GmbH, Sieburg, Germany
Comments Tentative assignment
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18O4
InChI InChI=1S/C11H18O4/c1-10(2)9(14)15-11(10)7(6-12)4-3-5-8(11)13/h7-8,12-13H,3-6H2,1-2H3
InChIKey ARLFQIJJRIPDIZ-UHFFFAOYSA-N
Melting Point 78-81C
Molecular Weight 214.26
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20
Synonyms 1-OXASPIRO/3.5/NONAN-2-ONE, 3,3-DIMETHYL-5-HYDROXY-9-/HYDROXYMETHYL/-, CYCLOHEXANEACETIC ACID, 1,2-DIHYDROXY-A,A-DIMETHYL-6-/HYDROXYMETHYL/-, B-LACTONE