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6-Methoxycoumarin-3-carboxylic acid
SpectraBase Compound ID DutRLwh7mTU
InChI InChI=1S/C11H8O5/c1-15-7-2-3-9-6(4-7)5-8(10(12)13)11(14)16-9/h2-5H,1H3,(H,12,13)
InChIKey XIQQAIQZABTSNZ-UHFFFAOYSA-N
Mol Weight 220.18 g/mol
Molecular Formula C11H8O5
Exact Mass 220.037173 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ED4g5mTFIEg
Name 6-Methoxycoumarin-3-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H8O5
InChI InChI=1S/C11H8O5/c1-15-7-2-3-9-6(4-7)5-8(10(12)13)11(14)16-9/h2-5H,1H3,(H,12,13)
InChIKey XIQQAIQZABTSNZ-UHFFFAOYSA-N
Instrument Name Hewlett- Packard-5972-MSD
Ionization Type EI
Literature Reference DOI 10.1021/acs.jmedchem.7b00918
Molecular Weight 220.180 g/mol
SMILES OC(C1=Cc2cc(ccc2OC1=O)OC)=O
SPLASH splash10-0259-1930000000-f5216d920abb8b1c5a7d
Source of Spectrum AF-60-SM4-7a
Wiley ID 1870149