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2,3-Dihydroxy-4-methyl-1-cyclohepta-2,4,6-trienone

View entire compound with spectra: 1 MS (GC)

2,3-Dihydroxy-4-methyl-1-cyclohepta-2,4,6-trienone
SpectraBase Compound ID ENSXc0HjY6f
InChI InChI=1S/C8H8O3/c1-5-3-2-4-6(9)8(11)7(5)10/h2-4H,1H3,(H2,9,10,11)
InChIKey CPNSHCHMSWIIAF-UHFFFAOYSA-N
Mol Weight 152.15 g/mol
Molecular Formula C8H8O3
Exact Mass 152.047344 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8mxbVEtmoDV
Name 2,3-Dihydroxy-4-methyl-1-cyclohepta-2,4,6-trienone
Alternate Name(s) 2,3-Dihydroxy-4-methyl-cyclohepta-2,4,6-trien-1-one 4-Methyl-2,3-bis(oxidanyl)cyclohepta-2,4,6-trien-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H8O3
InChI InChI=1S/C8H8O3/c1-5-3-2-4-6(9)8(11)7(5)10/h2-4H,1H3,(H2,9,10,11)
InChIKey CPNSHCHMSWIIAF-UHFFFAOYSA-N
Molecular Weight 152.149 g/mol
SMILES OC=1C(C(=C(C=CC1)C)O)=O
SPLASH splash10-0udi-1900000000-12b4bf578498d31176a4
Source of Spectrum K1-2004-1355-29
Wiley ID 1560536