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2-HYDROXYETHYLCAFFEATE

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2-HYDROXYETHYLCAFFEATE
SpectraBase Compound ID Hh3kyCrr10C
InChI InChI=1S/C11H12O5/c12-5-6-16-11(15)4-2-8-1-3-9(13)10(14)7-8/h1-4,7,12-14H,5-6H2/b4-2+
InChIKey GQMXXQFZDGUTPH-DUXPYHPUSA-N
Mol Weight 224.21 g/mol
Molecular Formula C11H12O5
Exact Mass 224.068473 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 64eDrh7BjYP
Name 2-HYDROXYETHYLCAFFEATE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H12O5
InChI InChI=1S/C11H12O5/c12-5-6-16-11(15)4-2-8-1-3-9(13)10(14)7-8/h1-4,7,12-14H,5-6H2/b4-2+
InChIKey GQMXXQFZDGUTPH-DUXPYHPUSA-N
Literature Reference Author M.DELLAGRECA,L.PREVITERA,R.PURCARO,A.ZARRELLI
Literature Reference Citation J.NAT.PROD.,70,1664(2007)
Literature Reference DOI 10.1021/np0702786
Molecular Weight 224.213 g/mol
Sample ID 31724
Solvent CD3OD