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METHYL-(R)-(-)-8-METHOXY-3-METHYL-1-OXO-3,4-DIHYDRO-(1H)-2-BENZOPYRAN-7-CARBOXYLATE
SpectraBase Compound ID 10tRovrOZXS
InChI InChI=1S/C13H14O5/c1-7-6-8-4-5-9(12(14)17-3)11(16-2)10(8)13(15)18-7/h4-5,7H,6H2,1-3H3/t7-/m1/s1
InChIKey LKYIYUVCKVADAN-SSDOTTSWSA-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 9ygAOulX73P
Name (3R)-1-keto-8-methoxy-3-methyl-isochroman-7-carboxylic acid methyl ester
Alternate Name(s) (3R)-8-methoxy-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-7-carboxylic acid methyl ester Methyl (3R)-8-methoxy-3-methyl-1-oxidanylidene-3,4-dihydroisochromene-7-carboxylate Methyl (3R)-8-methoxy-3-methyl-1-oxo-3,4-dihydroisochromene-7-carboxylate Methyl (3R)-8-methoxy-3-methyl-1-oxo-isochromane-7-carboxylate
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Formula C13H14O5
InChI InChI=1S/C13H14O5/c1-7-6-8-4-5-9(12(14)17-3)11(16-2)10(8)13(15)18-7/h4-5,7H,6H2,1-3H3/t7-/m1/s1
InChIKey LKYIYUVCKVADAN-SSDOTTSWSA-N
Molecular Weight 250.250 g/mol
SMILES c12C(O[C@@](Cc2ccc(c1OC)C(=O)OC)(C)[H])=O
SPLASH splash10-05cs-3940000000-413652d27ed43b49d2ee
Source of Spectrum B-55-217-23
Wiley ID 1516941