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5-[(1S)-1,2-DIACETOXYETHYL]-3-HYDROXYMETHYL-1-PHENYLPYRAZOLE
SpectraBase Compound ID BrwbI8v1YfH
InChI InChI=1S/C16H18N2O5/c1-11(20)22-10-16(23-12(2)21)15-8-13(9-19)17-18(15)14-6-4-3-5-7-14/h3-8,16,19H,9-10H2,1-2H3/t16-/m0/s1
InChIKey SJLZTJUFOHNLRC-INIZCTEOSA-N
Mol Weight 318.33 g/mol
Molecular Formula C16H18N2O5
Exact Mass 318.121572 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JVv5F3Z6fCL
Name 5-[(1S)-1,2-DIACETOXYETHYL]-3-HYDROXYMETHYL-1-PHENYLPYRAZOLE
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H18N2O5
InChI InChI=1S/C16H18N2O5/c1-11(20)22-10-16(23-12(2)21)15-8-13(9-19)17-18(15)14-6-4-3-5-7-14/h3-8,16,19H,9-10H2,1-2H3/t16-/m0/s1
InChIKey SJLZTJUFOHNLRC-INIZCTEOSA-N
Literature Reference Author N.OIKAWA,C.MUELLER,M.KUNZ,F.W.LICHTENTHALER
Literature Reference Citation CARBOHYDR.RES.,309,269(1998)
Literature Reference DOI 10.1016/S0008-6215(98)00137-2
Molecular Weight 318.329 g/mol
Solvent CDCl3
Source File Reference UWMP546