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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

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K4kdbtbk15F
Name (5-Formyl-2-furyl)methyl acetate
CAS Registry Number 10551-58-3
Copyright Copyright © 2020-2024 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
Molecular Weight 168.148 g/mol
SMILES c1(oc(cc1)COC(=O)C)C=O
SPLASH splash10-004i-9800000000-a024d07a9e7342db2393
Source of Spectrum LQ-1992-92-0
Synonyms (5-formylfuran-2-yl)methyl acetate (5-methanoylfuran-2-yl)methyl ethanoate 2-Furancarboxaldehyde, 5-[(acetyloxy)methyl]- 5-Acetoxymethyl-2-furaldehyde Acetic acid (5-formyl-2-furanyl)methyl ester Acetic acid (5-formyl-2-furyl)methyl ester
Wiley ID 1164115