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3-Acetyl-4-methylbenzonitrile
SpectraBase Compound ID 1GMkDqj2UGu
InChI InChI=1S/C10H9NO/c1-7-3-4-9(6-11)5-10(7)8(2)12/h3-5H,1-2H3
InChIKey SXJUDXWULIDYLR-UHFFFAOYSA-N
Mol Weight 159.19 g/mol
Molecular Formula C10H9NO
Exact Mass 159.068414 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BajO9PY1oye
Name 3-Acetyl-4-methylbenzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H9NO
InChI InChI=1S/C10H9NO/c1-7-3-4-9(6-11)5-10(7)8(2)12/h3-5H,1-2H3
InChIKey SXJUDXWULIDYLR-UHFFFAOYSA-N
Molecular Weight 159.188 g/mol
SMILES C(c1cc(c(cc1)C)C(=O)C)#N
SPLASH splash10-0006-0900000000-cdd4998f611adc989f16
Source of Spectrum F4-0-2628-9
Synonyms 3-Ethanoyl-4-methyl-benzenecarbonitrile
Wiley ID 1618765