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4'-Hydroxy-rot-2'-enonic acid

View entire compound with spectra: 1 NMR

4'-Hydroxy-rot-2'-enonic acid
SpectraBase Compound ID BLKQR2jKj34
InChI InChI=1S/C23H24O7/c1-12(10-24)4-5-13-16(25)7-6-14-22(26)21-15-8-18(27-2)19(28-3)9-17(15)29-11-20(21)30-23(13)14/h4,6-9,20-21,24-25H,5,10-11H2,1-3H3/b12-4+
InChIKey STQIAJVGXVCTSD-UUILKARUSA-N
Mol Weight 412.44 g/mol
Molecular Formula C23H24O7
Exact Mass 412.152203 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1OjQqJQwBuY
Name 4'-Hydroxy-rot-2'-enonic acid
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C23H24O7
InChI InChI=1S/C23H24O7/c1-12(10-24)4-5-13-16(25)7-6-14-22(26)21-15-8-18(27-2)19(28-3)9-17(15)29-11-20(21)30-23(13)14/h4,6-9,20-21,24-25H,5,10-11H2,1-3H3/b12-4+
InChIKey STQIAJVGXVCTSD-UUILKARUSA-N
Literature Reference P. Bhandari, L. Crombie, G.W. Kilbee, J. Chem. Soc. Perkin I 851 (1992).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6