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2H-1-Benzopyran-2-one, 4,5,7-trihydroxy-3-(4-methoxyphenyl)-
SpectraBase Compound ID IKwkTViea1l
InChI InChI=1S/C16H12O6/c1-21-10-4-2-8(3-5-10)13-15(19)14-11(18)6-9(17)7-12(14)22-16(13)20/h2-7,17-19H,1H3
InChIKey CIPQVCVRQQYHLE-UHFFFAOYSA-N
Mol Weight 300.27 g/mol
Molecular Formula C16H12O6
Exact Mass 300.063388 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I5dNVHSQijw
Name 2H-1-Benzopyran-2-one, 4,5,7-trihydroxy-3-(4-methoxyphenyl)-
Alternate Name(s) 4,5,7-Trihydroxy-3-(4-methoxyphenyl)-2H-chromen-2-one 2,4,5-trihydroxy-3-(4-methoxyphenyl)-7H-chromen-7-one 4,5,7-Trihydroxy-4'-methoxy-3-phenylcoumarin Coumarin, 4,5,7-trihydroxy-3-(p-methoxyphenyl)-
CAS Registry Number 4376-81-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12O6
InChI InChI=1S/C16H12O6/c1-21-10-4-2-8(3-5-10)13-15(19)14-11(18)6-9(17)7-12(14)22-16(13)20/h2-7,17-19H,1H3
InChIKey CIPQVCVRQQYHLE-UHFFFAOYSA-N
Molecular Weight 300.266 g/mol
SMILES Oc1cc2OC(C(=C(c2c(c1)O)O)c1ccc(OC)cc1)=O
SPLASH splash10-0002-1901000000-c0e8b819e47b8a1ad6cb
Source of Spectrum Y-2-258-4
Wiley ID 44474