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3-O-Butyryl.alpha.-D-lactose
SpectraBase Compound ID 1tnCSygz5c3
InChI InChI=1S/C16H28O12/c1-2-3-8(19)27-14-9(20)6(4-17)26-16(12(14)23)28-13-7(5-18)25-15(24)11(22)10(13)21/h6-7,9-18,20-24H,2-5H2,1H3
InChIKey VEQILRBONICFJP-UHFFFAOYSA-N
Mol Weight 412.39 g/mol
Molecular Formula C16H28O12
Exact Mass 412.158076 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1yK1DghTCA1
Name 3-O-Butyryl.alpha.-D-lactose
Comments SHIFTCORRECTION: 2.0 PPM (A.H.)
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Formula C16H28O12
InChI InChI=1S/C16H28O12/c1-2-3-8(19)27-14-9(20)6(4-17)26-16(12(14)23)28-13-7(5-18)25-15(24)11(22)10(13)21/h6-7,9-18,20-24H,2-5H2,1H3
InChIKey VEQILRBONICFJP-UHFFFAOYSA-N
Instrument Name Bruker WH-270
Literature Reference S. Riva, J. Choipineau, A.P. Kieboom, J. Am. Chem. Soc. 110, 584 (1988).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent D2O