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6-Chloro-3-(3,4-dimethoxyphenyl)chroman-4-one
SpectraBase Compound ID LgOHcTUuFbO
InChI InChI=1S/C17H15ClO4/c1-20-15-5-3-10(7-16(15)21-2)13-9-22-14-6-4-11(18)8-12(14)17(13)19/h3-8,13H,9H2,1-2H3
InChIKey AYGCUJLFXYAPET-UHFFFAOYSA-N
Mol Weight 318.76 g/mol
Molecular Formula C17H15ClO4
Exact Mass 318.065887 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 59owZlewMHz
Name 6-Chloro-3-(3,4-dimethoxyphenyl)chroman-4-one
Alternate Name(s) 6-Chloro-3-(3,4-dimethoxyphenyl)-3,4-dihydro-2H-1-benzopyran-4-one 6-Chloro-3-(3,4-dimethoxyphenyl)-2,3-dihydrochromen-4-one
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Formula C17H15ClO4
InChI InChI=1S/C17H15ClO4/c1-20-15-5-3-10(7-16(15)21-2)13-9-22-14-6-4-11(18)8-12(14)17(13)19/h3-8,13H,9H2,1-2H3
InChIKey AYGCUJLFXYAPET-UHFFFAOYSA-N
Molecular Weight 318.756 g/mol
SMILES C1(c2c(ccc(c2)Cl)OCC1c1cc(OC)c(cc1)OC)=O
SPLASH splash10-03di-0903000000-86c02053f9936aa2462b
Source of Spectrum U1-2010-1342-3k
Wiley ID 1663491