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4-(dioxidanyl)-4-methyl-cyclohexa-2,5-dien-1-one
SpectraBase Compound ID DgMbKrqhjIF
InChI InChI=1S/C7H8O3/c1-7(10-9)4-2-6(8)3-5-7/h2-5,9H,1H3
InChIKey DZAPYOAIROMSAL-UHFFFAOYSA-N
Mol Weight 140.14 g/mol
Molecular Formula C7H8O3
Exact Mass 140.047344 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DGTBWcIAiG1
Name 4-(dioxidanyl)-4-methyl-cyclohexa-2,5-dien-1-one
Alternate Name(s) 4-Hydroperoxy-4-methyl-1-cyclohexa-2,5-dienone 4-Hydroperoxy-4-methyl-cyclohexa-2,5-dien-1-one
CAS Registry Number 57749-82-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H8O3
InChI InChI=1S/C7H8O3/c1-7(10-9)4-2-6(8)3-5-7/h2-5,9H,1H3
InChIKey DZAPYOAIROMSAL-UHFFFAOYSA-N
Molecular Weight 140.138 g/mol
SMILES OOC1(C=CC(C=C1)=O)C
SPLASH splash10-0a6r-9800000000-c7f634d54730f59ef6cc
Source of Spectrum K-121-23-1
Wiley ID 1139131