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Acetic acid, tert-butyl ester
SpectraBase Compound ID FKO17pJmZcB
InChI InChI=1S/C6H12O2/c1-5(7)8-6(2,3)4/h1-4H3
InChIKey WMOVHXAZOJBABW-UHFFFAOYSA-N
Mol Weight 116.16 g/mol
Molecular Formula C6H12O2
Exact Mass 116.08373 g/mol

17O Nuclear Magnetic Resonance (NMR) Chemical Shifts

17O Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LOBachC1fNA
Name Acetic acid, tert-butyl ester
CAS Registry Number 540-88-5
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Formula C6H12O2
InChI InChI=1S/C6H12O2/c1-5(7)8-6(2,3)4/h1-4H3
InChIKey WMOVHXAZOJBABW-UHFFFAOYSA-N
Instrument Name SF = 080 MHz
Literature Reference Bull. Chem. Soc. Jap. 52, 3391 (1979).
NMR Standard not reported
Observed nucleus 17O
Solvent Neat liquid