3-Hydroxydecanoic acid

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Systematic / IUPAC Name: 3-Hydroxydecanoic acid

ID: Reference200

Other Names: Decanoic acid, 3-hydroxy-;
β-Hydroxydecanoic acid;
3-Hydroxydecanoate;
3-Hydroxycapric acid;
Myrmicacin

Formula: C10H20O3

Class: Endogenous Metabolites

Spectral Data

3-Hydroxydecanoic 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 177
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 10/10/2016 1:05:57 PM
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Identificators

InChI InChI=1S/C10H20O3/c1-2-3-4-5-6-7-9(11)8-10(12)13/h9,11H,2-8H2,1H3,(H,12,13)
InChI Key FYSSBMZUBSBFJL-UHFFFAOYSA-N
Canonical SMILES CCCCCCCC(CC(=O)O)O
CAS 5561875
Splash
Other Names Decanoic acid, 3-hydroxy-;
β-Hydroxydecanoic acid;
3-Hydroxydecanoate;
3-Hydroxycapric acid;
Myrmicacin;
3-HDA

In Other Databases

ChemIDPlus 014292263; 005561875; 033044916
ChemSpider 24790; 21238083
Wikipedia Myrmicacin
LipidsMAPs LMFA01050153
HMDb HMDB02203
PubChem 26612