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2H-1-Benzopyran-2-one, 3,5,7-trihydroxy-
SpectraBase Compound ID 4Dbthv3rzHD
InChI InChI=1S/C9H6O5/c10-4-1-6(11)5-3-7(12)9(13)14-8(5)2-4/h1-3,10-12H
InChIKey UVXDWGJSULDKQU-UHFFFAOYSA-N
Mol Weight 194.14 g/mol
Molecular Formula C9H6O5
Exact Mass 194.021523 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J4ZVhzKSKCK
Name 2H-1-Benzopyran-2-one, 3,5,7-trihydroxy-
Alternate Name(s) 3,5,7-Trihydroxy-2H-chromen-2-one Coumarin, 3,5,7-trihydroxy- 3,5,7-trihydroxychromen-2-one 3,5,7-Trihydroxy-2H-1-benzopyran-2-one
CAS Registry Number 22065-07-2
Comments Structure changed after expert review
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H6O5
InChI InChI=1S/C9H6O5/c10-4-1-6(11)5-3-7(12)9(13)14-8(5)2-4/h1-3,10-12H
InChIKey UVXDWGJSULDKQU-UHFFFAOYSA-N
Molecular Weight 194.142 g/mol
SMILES Oc1cc(cc2c1C=C(C(O2)=O)O)O
SPLASH splash10-014l-9600000000-fd3c411f12fdb2dc0d4a
Source of Spectrum EP-2119-0-0
Wiley ID 1190234