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7-[(1',1'-Dimethylallyl)oxy]-8-iodocoumarin
SpectraBase Compound ID 8uhwgTlv27a
InChI InChI=1S/C14H13IO3/c1-4-14(2,3)18-10-7-5-9-6-8-11(16)17-13(9)12(10)15/h4-8H,1H2,2-3H3
InChIKey KEFPCIVHQOAYJG-UHFFFAOYSA-N
Mol Weight 356.16 g/mol
Molecular Formula C14H13IO3
Exact Mass 355.990939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GeSeERJvYNs
Name 7-[(1',1'-Dimethylallyl)oxy]-8-iodocoumarin
Alternate Name(s) 7-[(1,1-dimethyl-2-propenyl)oxy]-8-iodo-2H-chromen-2-one 8-iodo-7-(2-methylbut-3-en-2-yloxy)-1-benzopyran-2-one 8-iodo-7-(2-methylbut-3-en-2-yloxy)chromen-2-one 7-(1,1-dimethylallyloxy)-8-iodo-chromen-2-one 8-iodanyl-7-(2-methylbut-3-en-2-yloxy)chromen-2-one
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Formula C14H13IO3
InChI InChI=1S/C14H13IO3/c1-4-14(2,3)18-10-7-5-9-6-8-11(16)17-13(9)12(10)15/h4-8H,1H2,2-3H3
InChIKey KEFPCIVHQOAYJG-UHFFFAOYSA-N
Molecular Weight 356.159 g/mol
SMILES c12c(c(OC(C=C)(C)C)ccc1C=CC(O2)=O)I
SPLASH splash10-000i-0090000000-17e9d98bd34a3298ee71
Source of Spectrum Y4-81-107-0
Wiley ID 1513298