Pinolenic acid methyl ester

Systematic / IUPAC Name: Methyl (5Z,9Z,12Z)-octadeca-5,9,12-trienoate

ID: Reference6606

Other Names: 5(Z),9(Z),12(Z)-Octadecatrienoic acid methyl ester

Formula: C19H32O2

Spectral Data

Pinolenic 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 1
No. of Spectra 163
Tandem Spectra MS1, MS2, MS3
Ionization Methods NSI
Analyzers FT
Last Modification 7/12/2017 12:24:46 PM
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Identificators

InChI InChI=1S/C19H32O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h7-8,10-11,14-15H,3-6,9,12-13,16-18H2,1-2H3/b8-7-,11-10-,15-14-
InChI Key UHRQLTPSFITDRF-BYKHLRFOSA-N
Canonical SMILES CCCCCC=CCC=CCCC=CCCCC(=O)OC
CAS 38406574
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Other Names 5(Z),9(Z),12(Z)-Octadecatrienoic acid methyl ester

In Other Databases

PubChem 35027731
ChemSpider 21467696