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2-Acetyl-3-methyl-1,4-benzoquinone
SpectraBase Compound ID 24aevVgQcFO
InChI InChI=1S/C9H8O3/c1-5-7(11)3-4-8(12)9(5)6(2)10/h3-4H,1-2H3
InChIKey XJTSVXRGMORBED-UHFFFAOYSA-N
Mol Weight 164.16 g/mol
Molecular Formula C9H8O3
Exact Mass 164.047344 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FakJ2o07P6U
Name 2-Acetyl-3-methyl-1,4-benzoquinone
Alternate Name(s) 2-Acetyl-3-methyl-p-benzoquinone 2-Acetyl-3-methylcyclohexa-2,5-diene-1,4-dione 2-Ethanoyl-3-methyl-cyclohexa-2,5-diene-1,4-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H8O3
InChI InChI=1S/C9H8O3/c1-5-7(11)3-4-8(12)9(5)6(2)10/h3-4H,1-2H3
InChIKey XJTSVXRGMORBED-UHFFFAOYSA-N
Molecular Weight 164.160 g/mol
SMILES C1(=C(C(=O)C=CC1=O)C)C(=O)C
SPLASH splash10-03k9-0900000000-9bff419080c96ebffd8e
Source of Spectrum SK-26-1269-11
Wiley ID 867098