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8-Acetyl-6-allyl-7-acetoxycoumarine
SpectraBase Compound ID JI5S3PvyZ4O
InChI InChI=1S/C16H14O5/c1-4-5-11-8-12-6-7-13(19)21-16(12)14(9(2)17)15(11)20-10(3)18/h4,6-8H,1,5H2,2-3H3
InChIKey FCCAVDLJPYADGH-UHFFFAOYSA-N
Mol Weight 286.28 g/mol
Molecular Formula C16H14O5
Exact Mass 286.084124 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fusibg6uGLC
Name 8-Acetyl-6-allyl-7-acetoxycoumarine
CAS Registry Number 86290-59-7
Comments Less than 3 mono-isotopic peaks
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Formula C16H14O5
InChI InChI=1S/C16H14O5/c1-4-5-11-8-12-6-7-13(19)21-16(12)14(9(2)17)15(11)20-10(3)18/h4,6-8H,1,5H2,2-3H3
InChIKey FCCAVDLJPYADGH-UHFFFAOYSA-N
Molecular Weight 286.283 g/mol
SMILES c1(c2OC(=O)C=Cc2cc(c1OC(=O)C)CC=C)C(=O)C
SPLASH splash10-000b-0090000000-69c1b493971db4f70a1b
Source of Spectrum J-48-2717-0
Synonyms 8-acetyl-6-allyl-2-oxo-2H-chromen-7-yl acetate
Wiley ID 1289798