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5-HYDROXY-2,4-PENTADIENAL, BENZOATE

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5-HYDROXY-2,4-PENTADIENAL, BENZOATE
SpectraBase Compound ID 6PPPrO5xMY3
InChI InChI=1S/C12H10O3/c13-9-5-2-6-10-15-12(14)11-7-3-1-4-8-11/h1-10H
InChIKey RIYSLXJAUWRKCX-UHFFFAOYSA-N
Mol Weight 202.21 g/mol
Molecular Formula C12H10O3
Exact Mass 202.062994 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5UPuUzVSwOG
Name 5-HYDROXY-2,4-PENTADIENAL, BENZOATE
Source of Sample J. P. Jacobsen, J. Becher Acta Chem. Scand. B 31, 519(1977)
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10O3
InChI InChI=1S/C12H10O3/c13-9-5-2-6-10-15-12(14)11-7-3-1-4-8-11/h1-10H
InChIKey RIYSLXJAUWRKCX-UHFFFAOYSA-N
Molecular Weight 202.21
Solvent Dimethyl sulfoxide-d6; Reference=TMS; Temperature=Ambient Spectrometer= Jeol FX-60
Synonyms 2,4-PENTADIENAL, 5-HYDROXY-, BENZOATE