Ricinoleic acid methyl ester

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Systematic / IUPAC Name: Methyl (9Z)-12-hydroxy-9-octadecenoate

ID: Reference6634

Other Names: 12R-hydroxy-9Z-octadecenoic acid, methyl ester ;
9-Octadecenoic acid, 12-hydroxy-, methyl ester, (Z)-;
Methyl 12-hydroxy-9-octadecenoate;
Methyl ricinoleate;
NSC 1254

Formula: C19H36O3

Spectral Data

Ricinoleic acid methyl ester 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 Fusion Lumos with ETD LBP
No. of Spectral Trees 2
No. of Spectra 3687
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods NSI
Analyzers FT
Last Modification 7/20/2017 2:02:41 PM
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Identificators

InChI InChI=1S/C19H36O3/c1-3-4-5-12-15-18(20)16-13-10-8-6-7-9-11-14-17-19(21)22-2/h10,13,18,20H,3-9,11-12,14-17H2,1-2H3/b13-10-
InChI Key XKGDWZQXVZSXAO-RAXLEYEMSA-N
Canonical SMILES CCCCCCC(CC=CCCCCCCCC(=O)OC)O
CAS 141242
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Other Names 12R-hydroxy-9Z-octadecenoic acid, methyl ester ;
9-Octadecenoic acid, 12-hydroxy-, methyl ester, (Z)-;
Methyl 12-hydroxy-9-octadecenoate;
Methyl ricinoleate;
NSC 1254

In Other Databases

PubChem 5364698
ChEMBL CHEMBL3183150
ChemIDPlus 000141242
ChemSpider 4516842