4-Methylcatechol

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Systematic / IUPAC Name: 4-Methyl-1,2-benzenediol

ID: Reference1699

Other Names: 3,4-Dihydroxytoluene;
p-Methylcatechol;
4-Methylpyrocatechol;
1,2-Dihydroxy-4-methylbenzene;
p-Methylpyrocatechol ; more

Formula: C7H8O2

Class: Endogenous Metabolites

Spectral Data

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

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Available MS Data

Used Instruments Orbitrap Elite
No. of Spectral Trees 1
No. of Spectra 86
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 12/2/2014 9:39:08 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C7H8O2/c1-5-2-3-6(8)7(9)4-5/h2-4,8-9H,1H3
InChI Key ZBCATMYQYDCTIZ-UHFFFAOYSA-N
Canonical SMILES CC1=CC(=C(C=C1)O)O
CAS 452868
Splash
Other Names 3,4-Dihydroxytoluene;
p-Methylcatechol;
4-Methylpyrocatechol;
1,2-Dihydroxy-4-methylbenzene;
p-Methylpyrocatechol;
Toluene-3,4-diol;
1,2-Benzenediol, 4-methyl-;
4-Methyl-1,2-dihydroxybenzene;
5-Methylcatechol;
Pyrocatechol, 4-methyl-;
2-Hydroxy-4-methylphenol;
4-Methylcatehol;
1-Methyl-3,4-dihydroxybenzene;
Homocatechol;
Homopyrocatechol

In Other Databases

ChemIDPlus 000452868
ChEBI CHEBI:17254
HMDb HMDB00873
PubChem 9958
ChemSpider 9564
ChEMBL CHEMBL158766
Wikipedia 4-Methylcatechol
KEGG C06730