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4-(4-acetylbenzyl)-2H-furan-5-one
SpectraBase Compound ID HGR3eEsl97R
InChI InChI=1S/C13H12O3/c1-9(14)11-4-2-10(3-5-11)8-12-6-7-16-13(12)15/h2-6H,7-8H2,1H3
InChIKey JONJLCOHFVCWCV-UHFFFAOYSA-N
Mol Weight 216.24 g/mol
Molecular Formula C13H12O3
Exact Mass 216.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AXKM4R4LCSt
Name 4-(4-acetylbenzyl)-2H-furan-5-one
Alternate Name(s) 4-[(4-acetylphenyl)methyl]-2H-furan-5-one 4-[(4-ethanoylphenyl)methyl]-2H-furan-5-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12O3
InChI InChI=1S/C13H12O3/c1-9(14)11-4-2-10(3-5-11)8-12-6-7-16-13(12)15/h2-6H,7-8H2,1H3
InChIKey JONJLCOHFVCWCV-UHFFFAOYSA-N
Molecular Weight 216.236 g/mol
SMILES C=1(C(OCC1)=O)Cc1ccc(C(=O)C)cc1
SPLASH splash10-0uxr-0970000000-303b2d07a9b6a24a35d6
Source of Spectrum K1-2001-3169-3
Wiley ID 814251