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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 6PVAF69oeWE
Name Methyl 4-acetylbenzoate
Appearance Colorless solid
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
Instrument Name Agilent Technologies 6890N-5973
Ionization Type EI
Literature Reference DOI 10.1002/anie.201710370
Molecular Weight 178.187 g/mol
Quality 612
SMILES C1=CC(=CC=C1C(=O)OC)C(=O)C
SPLASH splash10-0h03-9800000000-1d39ad862c8c312e480b
Source of Spectrum ACI-57-SM12-4h (DOI: 10.1002/anie.201710370)
Wiley ID 1891145