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5-Methoxy-coumarin
SpectraBase Compound ID CjkPXcxLzJZ
InChI InChI=1S/C10H8O3/c1-12-8-3-2-4-9-7(8)5-6-10(11)13-9/h2-6H,1H3
InChIKey XYFXTIBDEAZMAH-UHFFFAOYSA-N
Mol Weight 176.17 g/mol
Molecular Formula C10H8O3
Exact Mass 176.047344 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7dWoBc8qqwb
Name 5-Methoxy-2H-chromen-2-one
Appearance Colorless crystalline solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H8O3
InChI InChI=1S/C10H8O3/c1-12-8-3-2-4-9-7(8)5-6-10(11)13-9/h2-6H,1H3
InChIKey XYFXTIBDEAZMAH-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1021/acs.joc.0c02011
Molecular Weight 176.171 g/mol
Reported Formula C10H8O3
SMILES C1=Cc2c(OC1=O)cccc2OC
SPLASH splash10-005a-0900000000-755499f0a6f52dff4d6b
Source of Spectrum JOC-86-191-108
Thin-Layer Chromatography Rf = 0.4 (chloroform)
Wiley ID 1854921