1-Oxo-1H-2-benzopyran-3-carboxaldehyde (CHEBI:173471)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	1-Oxo-1H-2-benzopyran-3-carboxaldehyde

ChEBI ID	CHEBI:173471

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C10H6O3

Net Charge

Average Mass

174.155

Monoisotopic Mass

174.03169

InChI

InChI=1S/C10H6O3/c11-6-8-5-7-3-1-2-4-9(7)10(12)13-8/h1-6H

InChIKey

ALHVSADYXQWYJH-UHFFFAOYSA-N

SMILES

O1C(=O)C=2C(C=C1C=O)=CC=CC2

ChEBI Ontology
Outgoing	1-Oxo-1H-2-benzopyran-3-carboxaldehyde (CHEBI:173471) is a isocoumarins (CHEBI:38758)

IUPAC Name

1-oxoisochromene-3-carbaldehyde