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2,3-dihydroxy-6-methyl-1-cyclohepta-2,4,6-trienone
SpectraBase Compound ID JfVG8L46lnf
InChI InChI=1S/C8H8O3/c1-5-2-3-6(9)8(11)7(10)4-5/h2-4H,1H3,(H2,9,10,11)
InChIKey LTYPWDAORXWBGR-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 4VDJdz5Tcbh
Name 2,3-dihydroxy-6-methyl-1-cyclohepta-2,4,6-trienone
Alternate Name(s) 2,3-dihydroxy-6-methyl-cyclohepta-2,4,6-trien-1-one 6-methyl-2,3-bis(oxidanyl)cyclohepta-2,4,6-trien-1-one
Comments Less than 3 mono-isotopic peaks
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Formula C8H8O3
InChI InChI=1S/C8H8O3/c1-5-2-3-6(9)8(11)7(10)4-5/h2-4H,1H3,(H2,9,10,11)
InChIKey LTYPWDAORXWBGR-UHFFFAOYSA-N
Molecular Weight 152.149 g/mol
SMILES OC=1C(C(=CC(=CC1)C)O)=O
SPLASH splash10-0uk9-0900000000-467dcdfdb498fece4692
Source of Spectrum B-44-705-0
Wiley ID 1148817