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5-Benzyloxy-6-methoxy-3-methylisocoumarin
SpectraBase Compound ID KUmI8wmcMnv
InChI InChI=1S/C18H16O4/c1-12-10-15-14(18(19)22-12)8-9-16(20-2)17(15)21-11-13-6-4-3-5-7-13/h3-10H,11H2,1-2H3
InChIKey POCFANKNYRXGNA-UHFFFAOYSA-N
Mol Weight 296.32 g/mol
Molecular Formula C18H16O4
Exact Mass 296.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CViDdSmOAoK
Name 5-Benzyloxy-6-methoxy-3-methylisocoumarin
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16O4
InChI InChI=1S/C18H16O4/c1-12-10-15-14(18(19)22-12)8-9-16(20-2)17(15)21-11-13-6-4-3-5-7-13/h3-10H,11H2,1-2H3
InChIKey POCFANKNYRXGNA-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol302256y
Molecular Weight 296.322 g/mol
SMILES c1(OC)ccc2c(c1OCc1ccccc1)C=C(C)OC2=O
SPLASH splash10-0006-9110000000-bb2f329698d6c90cf144
Source of Spectrum A1-14-4930/SMSI5-3f
Synonyms 5-(benzyloxy)-6-methoxy-3-methyl-1H-isochromen-1-one
Wiley ID 1750631