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JSODNIIBTFVQMN-UHFFFAOYSA-N
SpectraBase Compound ID J3kGbVR6Z1B
InChI InChI=1S/C12H12O3/c1-7-3-4-8-6-10(12(14)15-2)11(13)9(8)5-7/h3-5,10H,6H2,1-2H3
InChIKey JSODNIIBTFVQMN-UHFFFAOYSA-N
Mol Weight 204.22 g/mol
Molecular Formula C12H12O3
Exact Mass 204.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KbXGz0XEbrm
Name 1-keto-6-methyl-indane-2-carboxylic acid methyl ester
Alternate Name(s) 5-Methyl-3-oxo-1,2-dihydroindene-2-carboxylic acid methyl ester Methyl 5-methyl-3-oxidanylidene-1,2-dihydroindene-2-carboxylate Methyl 5-methyl-3-oxo-1,2-dihydroindene-2-carboxylate Methyl 6-methyl-1-oxo-2-indanecarboxylate Methyl 6-methyl-1-oxo-indane-2-carboxylate
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Formula C12H12O3
InChI InChI=1S/C12H12O3/c1-7-3-4-8-6-10(12(14)15-2)11(13)9(8)5-7/h3-5,10H,6H2,1-2H3
InChIKey JSODNIIBTFVQMN-UHFFFAOYSA-N
Molecular Weight 204.225 g/mol
SMILES C1(C(c2cc(C)ccc2C1)=O)C(=O)OC
SPLASH splash10-0f6y-0930000000-0f226bb9a1ecb87f477a
Source of Spectrum AH-127-432-25
Wiley ID 1201869