4-Hydroxybutyric acid (GHB)

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Systematic / IUPAC Name: 4-Hydroxybutanoic acid

ID: Reference1486

Other Names: Butanoic acid, 4-hydroxy-;
Υ-Hydroxybutyrate;
Butyric acid, 4-hydroxy-;
Xyrem;
Sodium oxybate ; more

Formula: C4H8O3

Class: Therapeutics/Prescription Drugs Drugs of Abuse/Illegal Drugs Endogenous Metabolites

Spectral Data

4-Hydroxybutyric acid (GHB) 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 Q Exactive Orbitrap; Q Exactive Plus Orbitrap
No. of Spectral Trees 3
No. of Spectra 247
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 11/15/2018 8:28:00 AM
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Identificators

InChI InChI=1S/C4H8O3/c5-3-1-2-4(6)7/h5H,1-3H2,(H,6,7)
InChI Key SJZRECIVHVDYJC-UHFFFAOYSA-N
Canonical SMILES C(CC(=O)O)CO
CAS 591811
Splash
Other Names Butanoic acid, 4-hydroxy-;
Υ-Hydroxybutyrate;
Butyric acid, 4-hydroxy-;
Xyrem;
Sodium oxybate;
Oxybate;
Sodium Υ-oxybutyrate

In Other Databases

Wikipedia Gamma-Hydroxybutyric acid
PubChem 10413
KEGG C00989; C01991
LipidsMAPs LMFA01050006
ChEMBL CHEMBL1342
ChEBI CHEBI:30830
ChemSpider 9984
HMDb HMDB00710
ChemIDPlus 000502852; 000591811; 063255298; 001320612; 052352279