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Methyl 4-acetylbenzoate
SpectraBase Compound ID mrZ8Y5Hht7
InChI InChI=1S/C10H10O3/c1-7(11)8-3-5-9(6-4-8)10(12)13-2/h3-6H,1-2H3
InChIKey QNTSFZXGLAHYLC-UHFFFAOYSA-N
Mol Weight 178.19 g/mol
Molecular Formula C10H10O3
Exact Mass 178.062994 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 75yRNDAGquY
Name Methyl 4-acetylbenzoate
Alternate Name(s) 4-Acetylbenzoic acid methyl ester Benzoic acid, 4-acetyl-, methyl ester Methyl 4-ethanoylbenzoate
CAS Registry Number 3609-53-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H10O3
InChI InChI=1S/C10H10O3/c1-7(11)8-3-5-9(6-4-8)10(12)13-2/h3-6H,1-2H3
InChIKey QNTSFZXGLAHYLC-UHFFFAOYSA-N
Molecular Weight 178.187 g/mol
SMILES C(c1ccc(cc1)C(=O)C)(=O)OC
SPLASH splash10-03di-0900000000-52162998f0499a3a1680
Source of Spectrum I-69-430-9
Wiley ID 1173979