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Methyl 7-Benzyloxy-8-methoxy-1-oxo-6-phenylethynyl-1H-isochromene-3-carboxylate
SpectraBase Compound ID IyZ8gFRfepX
InChI InChI=1S/C27H20O6/c1-30-25-23-21(16-22(26(28)31-2)33-27(23)29)15-20(14-13-18-9-5-3-6-10-18)24(25)32-17-19-11-7-4-8-12-19/h3-12,15-16H,17H2,1-2H3
InChIKey YQSDKZIMKYVXBK-UHFFFAOYSA-N
Mol Weight 440.45 g/mol
Molecular Formula C27H20O6
Exact Mass 440.125988 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4uVeSXZfHe0
Name Methyl 7-Benzyloxy-8-methoxy-1-oxo-6-phenylethynyl-1H-isochromene-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H20O6
InChI InChI=1S/C27H20O6/c1-30-25-23-21(16-22(26(28)31-2)33-27(23)29)15-20(14-13-18-9-5-3-6-10-18)24(25)32-17-19-11-7-4-8-12-19/h3-12,15-16H,17H2,1-2H3
InChIKey YQSDKZIMKYVXBK-UHFFFAOYSA-N
Molecular Weight 440.451 g/mol
SMILES C=1(OC(c2c(c(c(cc2C1)C#Cc1ccccc1)OCc1ccccc1)OC)=O)C(=O)OC
SPLASH splash10-0006-9001200000-afcb3f0d9ff938fc50e8
Source of Spectrum F4-0-3578-23
Synonyms Methyl 7-(benzyloxy)-8-methoxy-1-oxo-6-(phenylethynyl)-1H-2-benzopyran-3-carboxylate
Wiley ID 1619164