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7-O-Propargylscopoletin (7-Propargyloxy-6-methyloxycoumarin)
SpectraBase Compound ID 56H7AO8SgDy
InChI InChI=1S/C13H10O4/c1-3-6-16-12-8-10-9(7-11(12)15-2)4-5-13(14)17-10/h1,4-5,7-8H,6H2,2H3
InChIKey PGKBQGLSGDSEOS-UHFFFAOYSA-N
Mol Weight 230.22 g/mol
Molecular Formula C13H10O4
Exact Mass 230.057909 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JXD08x6oFLa
Name 7-O-Propargylscopoletin (7-Propargyloxy-6-methyloxycoumarin)
Alternate Name(s) 6-Methoxy-7-prop-2-ynoxy-1-benzopyran-2-one 6-Methoxy-7-prop-2-ynoxychromen-2-one 6-Methoxy-7-prop-2-ynoxy-chromen-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H10O4
InChI InChI=1S/C13H10O4/c1-3-6-16-12-8-10-9(7-11(12)15-2)4-5-13(14)17-10/h1,4-5,7-8H,6H2,2H3
InChIKey PGKBQGLSGDSEOS-UHFFFAOYSA-N
Molecular Weight 230.219 g/mol
SMILES c12OC(=O)C=Cc2cc(OC)c(c1)OCC#C
SPLASH splash10-01qc-0960000000-1ef918954b878506d10e
Source of Spectrum Y1-41-860-3
Wiley ID 1564999