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3-HYDROXY-5-OXO-2-PHENETHYL-1-CYCLOPENTENE-1-PROPIONIC ACID, METHYLESTER

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3-HYDROXY-5-OXO-2-PHENETHYL-1-CYCLOPENTENE-1-PROPIONIC ACID, METHYLESTER
SpectraBase Compound ID 1HewQh2L2DM
InChI InChI=1S/C17H20O4/c1-21-17(20)10-9-14-13(15(18)11-16(14)19)8-7-12-5-3-2-4-6-12/h2-6,15,18H,7-11H2,1H3
InChIKey QBKWJDGADZAZFV-UHFFFAOYSA-N
Mol Weight 288.34 g/mol
Molecular Formula C17H20O4
Exact Mass 288.136159 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A4YhGXQNeEi
Name 3-HYDROXY-5-OXO-2-PHENETHYL-1-CYCLOPENTENE-1-PROPIONIC ACID, METHYLESTER
Source of Sample D. M. Rackham, S. E. Cowdrey Org. Magn. Resonance 9, 160(1977)
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H20O4
InChI InChI=1S/C17H20O4/c1-21-17(20)10-9-14-13(15(18)11-16(14)19)8-7-12-5-3-2-4-6-12/h2-6,15,18H,7-11H2,1H3
InChIKey QBKWJDGADZAZFV-UHFFFAOYSA-N
Molecular Weight 288.35
Solvent Chloroform-d; Reference=TMS; Temperature=Ambient Spectrometer= Bruker WH-90
Synonyms 1-CYCLOPENTENE-1-PROPIONIC ACID, 3-HYDROXY-5-OXO-2-PHENETHYL-, METHYL ESTER