2-Methoxyresorcinol
615
Reference
2-Methoxyresorcinol Structure
Systematic / IUPAC Name: 2-Methoxy-1,3-benzenediol
ID: Reference615
Other Names:
2-Methoxybenzene-1,3-diol;
2-O-Methylpyrogallol;
1,3-Benzenediol, 2-methoxy-;
1,3-Dihydroxy-2-methoxybenzene
Formula: C7H8O3
Class: Endogenous Metabolites
Spectral Data
2-Methoxyresorcinol mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Available MS Data
| Used Instruments | Q Exactive Orbitrap |
| No. of Spectral Trees | 1 |
| No. of Spectra | 75 |
| Tandem Spectra | MS1, MS2 |
| Ionization Methods | ESI |
| Analyzers | FT |
| Last Modification | 2/12/2015 10:23:59 AM |
Identificators
| InChI | InChI=1S/C7H8O3/c1-10-7-5(8)3-2-4-6(7)9/h2-4,8-9H,1H3 |
| InChI Key | QFYYAIBEHOEZKC-UHFFFAOYSA-N |
| Canonical SMILES | COC1=C(C=CC=C1O)O |
| CAS | 29267672 |
| Splash | |
| Other Names |
2-Methoxybenzene-1,3-diol; 2-O-Methylpyrogallol; 1,3-Benzenediol, 2-methoxy-; 1,3-Dihydroxy-2-methoxybenzene |
In Other Databases
| ChEMBL | CHEMBL485792 |
| ChemSpider | 108676 |
| PubChem | 121805 |
| ChemIDPlus | 029267672 |