Catechol
2991
Reference
Catechol Structure
Systematic / IUPAC Name: Benzene-1,2-diol
ID: Reference2991
Other Names:
o-Hydroquinone;
Benzcatechin;
CAQ;
Catechol;
Fourrine 68
; more
Formula: C6H6O2
Class: Endogenous Metabolites Industrial Chemicals Excipients/Additives/Colorants Personal Care Products/Cosmetics
Spectral Data
Catechol 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 | 118 |
| Tandem Spectra | MS1, MS2 |
| Ionization Methods | ESI |
| Analyzers | FT |
| Last Modification | 9/7/2015 8:37:51 AM |
Identificators
| InChI | InChI=1S/C6H6O2/c7-5-3-1-2-4-6(5)8/h1-4,7-8H |
| InChI Key | YCIMNLLNPGFGHC-UHFFFAOYSA-N |
| Canonical SMILES | C1=CC=C(C(=C1)O)O |
| CAS | 120809 |
| Splash | |
| Other Names |
o-Hydroquinone; Benzcatechin; CAQ; Catechol; Fourrine 68; Kachin; Katechol; Oxyphenate; Oxyphenic acid; Pelagol grey C; Phthalhydroquinone; Phthalic alcohol; Pyrocatechin; Pyrocatechine; Pyrocatechinic acid; Pyrocatechinic acidpyrocatechol; Pyrocatechol; Pyrokatechol; α-Hydroxyphenol; o-Benzenediol; o-Dihydroxybenzene; o-Dioxybenzene; o-Hydroxyphenol; o-Phenylenediol; 1,2-Benzenediol; 1,2-Dihydroxybenzene; 2H-1-Benzopyran-3,5,7-triol, 2-(3,4-dihydroxyphenyl)-3,4-dihydro,(2R-trans-)-; Benzene, o-dihydroxy-; Benzenediol; Hydroxyl phenol; Fouramine PCH |