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2-Oxopentanoic acid, 2'-acetylphenyl ester
SpectraBase Compound ID KcxnHkyJmAE
InChI InChI=1S/C13H14O4/c1-3-6-11(15)13(16)17-12-8-5-4-7-10(12)9(2)14/h4-5,7-8H,3,6H2,1-2H3
InChIKey GLMAJVZTPXWTGD-UHFFFAOYSA-N
Mol Weight 234.25 g/mol
Molecular Formula C13H14O4
Exact Mass 234.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BMmgeIZdiTw
Name 2-Oxopentanoic acid, 2'-acetylphenyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14O4
InChI InChI=1S/C13H14O4/c1-3-6-11(15)13(16)17-12-8-5-4-7-10(12)9(2)14/h4-5,7-8H,3,6H2,1-2H3
InChIKey GLMAJVZTPXWTGD-UHFFFAOYSA-N
Molecular Weight 234.251 g/mol
SMILES c1ccc(c(OC(C(CCC)=O)=O)c1)C(=O)C
SPLASH splash10-00du-9500000000-3ba7fa7a001b55b5b26a
Synonyms (2-acetylphenyl) 2-oxopentanoate (2-ethanoylphenyl) 2-oxidanylidenepentanoate 2-ketovaleric acid (2-acetylphenyl) ester 2-Oxopentanoic acid (2-acetylphenyl) ester
Wiley ID 1490767