3-Furoic acid

enlarge

Systematic / IUPAC Name: 3-Furoic acid

ID: Reference1735

Other Names: Furan-3-carboxylic acid;
3-Carboxyfuran;
3-Furanoic acid;
3-Furoate

Formula: C5H4O3

Class: Endogenous Metabolites

Spectral Data

3-Furoic acid mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 1
No. of Spectra 73
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 12/1/2014 5:20:13 PM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C5H4O3/c6-5(7)4-1-2-8-3-4/h1-3H,(H,6,7)
InChI Key IHCCAYCGZOLTEU-UHFFFAOYSA-N
Canonical SMILES C1=COC=C1C(=O)O
CAS 488937
Splash
Other Names Furan-3-carboxylic acid;
3-Carboxyfuran;
3-Furanoic acid;
3-Furoate

In Other Databases

ChemSpider 9849
ChEBI CHEBI:30846
ChemIDPlus 000488937
PubChem 10268
HMDb HMDB00444