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8-Methoxy-3-[(2''-methyl-1'',3''-dithiolan-2''-yl)methyl]-1H-isochromen-1-one
SpectraBase Compound ID LqBrL4yEHlW
InChI InChI=1S/C15H16O3S2/c1-15(19-6-7-20-15)9-11-8-10-4-3-5-12(17-2)13(10)14(16)18-11/h3-5,8H,6-7,9H2,1-2H3
InChIKey HGQNJXVNXQZUDV-UHFFFAOYSA-N
Mol Weight 308.41 g/mol
Molecular Formula C15H16O3S2
Exact Mass 308.054087 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KGVy0G68txf
Name 8-Methoxy-3-[(2''-methyl-1'',3''-dithiolan-2''-yl)methyl]-1H-isochromen-1-one
Alternate Name(s) 8-Methoxy-3-[(2-methyl-1,3-dithiolan-2-yl)methyl]-2-benzopyran-1-one 8-Methoxy-3-[(2-methyl-1,3-dithiolan-2-yl)methyl]isochromen-1-one
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Formula C15H16O3S2
InChI InChI=1S/C15H16O3S2/c1-15(19-6-7-20-15)9-11-8-10-4-3-5-12(17-2)13(10)14(16)18-11/h3-5,8H,6-7,9H2,1-2H3
InChIKey HGQNJXVNXQZUDV-UHFFFAOYSA-N
Molecular Weight 308.410 g/mol
SMILES C1(c2c(cccc2OC)C=C(O1)CC1(SCCS1)C)=O
SPLASH splash10-00kf-6911000000-27bbc8d2af5f2ee38d43
Source of Spectrum U1-2010-3086-17
Wiley ID 1663830