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Methyl (3,4,5,8-tetrahydro-1-methyl-5,8-dioxo-1H-2-benzopyran-3-yl)acetate

View entire compound with spectra: 1 MS (GC)

Methyl (3,4,5,8-tetrahydro-1-methyl-5,8-dioxo-1H-2-benzopyran-3-yl)acetate
SpectraBase Compound ID HJHe2MCazxS
InChI InChI=1S/C13H14O5/c1-7-13-9(10(14)3-4-11(13)15)5-8(18-7)6-12(16)17-2/h3-4,7-8H,5-6H2,1-2H3
InChIKey BWFXUMFLKTUKDZ-UHFFFAOYSA-N
Mol Weight 250.25 g/mol
Molecular Formula C13H14O5
Exact Mass 250.084124 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1ffvPrYbf11
Name Methyl (3,4,5,8-tetrahydro-1-methyl-5,8-dioxo-1H-2-benzopyran-3-yl)acetate
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Formula C13H14O5
InChI InChI=1S/C13H14O5/c1-7-13-9(10(14)3-4-11(13)15)5-8(18-7)6-12(16)17-2/h3-4,7-8H,5-6H2,1-2H3
InChIKey BWFXUMFLKTUKDZ-UHFFFAOYSA-N
Molecular Weight 250.250 g/mol
SMILES C12=C(C(C)OC(C2)CC(=O)OC)C(=O)C=CC1=O
SPLASH splash10-004i-0960000000-315601853fbc7f5abc45
Source of Spectrum U-1996-1389-10
Synonyms Methyl (1-methyl-5,8-dioxo-3,4,5,8-tetrahydro-1H-2-benzopyran-3-yl)acetate Methyl (3,4,5,8-tetrahydro-1-dimethyl-5,8-dioxo-1H-2-benzopyran-3-yl)acetate
Wiley ID 768814