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acetic acid, ester with 5-(hydroxymethyl)-2-furaldehyde

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acetic acid, ester with 5-(hydroxymethyl)-2-furaldehyde
SpectraBase Compound ID 7pc1xSewh5p
InChI InChI=1S/C8H8O4/c1-6(10)11-5-8-3-2-7(4-9)12-8/h2-4H,5H2,1H3
InChIKey QAVITTVTXPZTSE-UHFFFAOYSA-N
Mol Weight 168.15 g/mol
Molecular Formula C8H8O4
Exact Mass 168.042259 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D247Tdmhxhw
Name ACETIC ACID, ESTER WITH 5-(HYDROXYMETHYL)-2-FURALDEHYDE
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Comments Tentative assignment
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H8O4
InChI InChI=1S/C8H8O4/c1-6(10)11-5-8-3-2-7(4-9)12-8/h2-4H,5H2,1H3
InChIKey QAVITTVTXPZTSE-UHFFFAOYSA-N
Melting Point 53-55C
Molecular Weight 168.15
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms ACETIC ACID, ESTER WITH 5-/HYDROXYMETHYL/-2-FURALDEHYDE 2-FURALDEHYDE, 5-/ACETOXYMETHYL/-,