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3-(3-hydroxypropyl)-4,6-dimethoxy-3H-2-benzofuran-1-one
SpectraBase Compound ID HxMNICiK2ZX
InChI InChI=1S/C13H16O5/c1-16-8-6-9-12(11(7-8)17-2)10(4-3-5-14)18-13(9)15/h6-7,10,14H,3-5H2,1-2H3
InChIKey GAHTXJRMVVZWQE-UHFFFAOYSA-N
Mol Weight 252.27 g/mol
Molecular Formula C13H16O5
Exact Mass 252.099774 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IW1o1JMWLY1
Name 3-(3-hydroxypropyl)-4,6-dimethoxy-3H-2-benzofuran-1-one
Alternate Name(s) 3-(3-hydroxypropyl)-4,6-dimethoxy-3H-isobenzofuran-1-one 3-(3-hydroxypropyl)-4,6-dimethoxy-phthalide 4,6-Dimethoxy-3-(3-oxidanylpropyl)-3H-2-benzofuran-1-one
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Formula C13H16O5
InChI InChI=1S/C13H16O5/c1-16-8-6-9-12(11(7-8)17-2)10(4-3-5-14)18-13(9)15/h6-7,10,14H,3-5H2,1-2H3
InChIKey GAHTXJRMVVZWQE-UHFFFAOYSA-N
Molecular Weight 252.266 g/mol
SMILES OCCCC1c2c(C(O1)=O)cc(cc2OC)OC
SPLASH splash10-004o-9820000000-b1970bc1184ee47e07f2
Source of Spectrum SO-0-860-22
Wiley ID 863873