3,4-Dihydroxybenzaldehyde

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Systematic / IUPAC Name: 3,4-Dihydroxybenzaldehyde

ID: Reference3393

Other Names: BR-39223;
Protocatechualdehyde;
Protocatechuic aldehyde;
Rancinamycin IV;
1,2-Dihydroxy-4-formylbenzene ; more

Formula: C7H6O3

Class: Endogenous Metabolites Excipients/Additives/Colorants Therapeutics/Prescription Drugs

Spectral Data

3,4-Dihydroxybenzaldehyde 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 294
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 11/19/2015 3:20:35 PM
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Identificators

InChI InChI=1S/C7H6O3/c8-4-5-1-2-6(9)7(10)3-5/h1-4,9-10H
InChI Key IBGBGRVKPALMCQ-UHFFFAOYSA-N
Canonical SMILES C1=CC(=C(C=C1C=O)O)O
CAS 139855
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Other Names BR-39223;
Protocatechualdehyde;
Protocatechuic aldehyde;
Rancinamycin IV;
1,2-Dihydroxy-4-formylbenzene;
3,4-Dihydroxy benzaldehyde;
3,4-Dihydroxybenzenecarbonal;
3,4-Dihydroxybenzyl aldehyde;
4-Formyl-1,2-benzenediol;
4-Formyl-1,2-dihydroxybenzene;
4-Formylbenzene-1,2-diol;
4-Formylcatechol;
Benzaldehyde, 3,4-dihydroxy-

In Other Databases

Wikipedia Protocatechuic aldehyde
ChEBI CHEBI:50205
ChemIDPlus 000139855
ChemSpider 8438
KEGG C16700
HMDb HMDB59965
PubChem 8768