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phenylmalonic acid, cyclic isopropylidene ester
SpectraBase Compound ID L5jwZIREMBo
InChI InChI=1S/C12H12O4/c1-12(2)15-10(13)9(11(14)16-12)8-6-4-3-5-7-8/h3-7,9H,1-2H3
InChIKey NTUAHNQWHPQAMB-UHFFFAOYSA-N
Mol Weight 220.22 g/mol
Molecular Formula C12H12O4
Exact Mass 220.073559 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JLfXh1WQndG
Name PHENYLMALONIC ACID, CYCLIC ISOPROPYLIDENE ESTER
Source of Sample Tokyo Kasei Kogyo Company, Ltd., Tokyo, Japan
CAS Registry Number 15231-78-4
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12O4
InChI InChI=1S/C12H12O4/c1-12(2)15-10(13)9(11(14)16-12)8-6-4-3-5-7-8/h3-7,9H,1-2H3
InChIKey NTUAHNQWHPQAMB-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Molecular Weight 220.23
Solvent CDCl3; Reference=TMS; Temperature 297K