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3-ETHOXYCARBONYL-4-HYDROXYCOUMARIN
SpectraBase Compound ID Gv9Y9fOi5wL
InChI InChI=1S/C12H10O5/c1-2-16-11(14)9-10(13)7-5-3-4-6-8(7)17-12(9)15/h3-6,13H,2H2,1H3
InChIKey RAGGBDBRGYOOED-UHFFFAOYSA-N
Mol Weight 234.21 g/mol
Molecular Formula C12H10O5
Exact Mass 234.052823 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5SJWQFgElHH
Name 2H-1-Benzopyran-3-carboxylic acid, 4-hydroxy-2-oxo-, ethyl ester
Alternate Name(s) Ethyl 4-hydroxy-2-oxo-2H-1-benzoplyran-3-carboxylate
CAS Registry Number 1821-20-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10O5
InChI InChI=1S/C12H10O5/c1-2-16-11(14)9-10(13)7-5-3-4-6-8(7)17-12(9)15/h3-6,13H,2H2,1H3
InChIKey RAGGBDBRGYOOED-UHFFFAOYSA-N
Molecular Weight 234.207 g/mol
SMILES OC1=C(C(Oc2c1cccc2)=O)C(=O)OCC
SPLASH splash10-00di-1900000000-45b84857493d312e33a2
Source of Spectrum KC-66-1712-1
Wiley ID 31658