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3-(Phenyl)-8-methoxy-4-methylisocoumarin
SpectraBase Compound ID LhGisPM7WVn
InChI InChI=1S/C17H14O3/c1-11-13-9-6-10-14(19-2)15(13)17(18)20-16(11)12-7-4-3-5-8-12/h3-10H,1-2H3
InChIKey VTENMFKQOBBUDO-UHFFFAOYSA-N
Mol Weight 266.3 g/mol
Molecular Formula C17H14O3
Exact Mass 266.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KbkVBaju4Rb
Name 3-(Phenyl)-8-methoxy-4-methylisocoumarin
Alternate Name(s) 8-Methoxy-4-methyl-3-phenyl-2-benzopyran-1-one 8-Methoxy-4-methyl-3-phenyl-1H-isochromen-1-one 8-Methoxy-4-methyl-3-phenylisochromen-1-one 8-Methoxy-4-methyl-3-phenyl-isochromen-1-one
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Formula C17H14O3
InChI InChI=1S/C17H14O3/c1-11-13-9-6-10-14(19-2)15(13)17(18)20-16(11)12-7-4-3-5-8-12/h3-10H,1-2H3
InChIKey VTENMFKQOBBUDO-UHFFFAOYSA-N
Literature Reference DOI 10.1002/anie.201500600
Molecular Weight 266.296 g/mol
SMILES C=1(C)c2cccc(c2C(=O)OC1c1ccccc1)OC
SPLASH splash10-014i-2290000000-8a88f3e754b31d4e81d1
Source of Spectrum ACI-54-5513/SMS27-3fd
Wiley ID 1761162