3,4-Dihydroxybenzenesulfonic acid

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Systematic / IUPAC Name: 3,4-Dihydroxybenzenesulfonic acid

ID: Reference185

Other Names: Benzenesulfonic acid, 3,4-dihydroxy-;
4-Sulfocatechol

Formula: C6H6O5S

Spectral Data

3,4-Dihydroxybenzenesulfonic acid 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 134
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 11/14/2014 9:47:41 AM
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Identificators

InChI InChI=1S/C6H6O5S/c7-5-2-1-4(3-6(5)8)12(9,10)11/h1-3,7-8H,(H,9,10,11)
InChI Key LTPDITOEDOAWRU-UHFFFAOYSA-N
Canonical SMILES C1=CC(=C(C=C1S(=O)(=O)O)O)O
CAS 7134090
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Other Names Benzenesulfonic acid, 3,4-dihydroxy-;
4-Sulfocatechol

In Other Databases

ChEBI CHEBI:27758
PubChem 189003
KEGG C06674
ChemSpider 164229
ChemIDPlus 007134090