cis-12-Octadecenoic acid methyl ester

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

ID: Reference6658

Other Names: (Z)-12-Octadecenoic acid methyl ester;
(Z)-Methyl octadec-12-enoate;
Methyl (12Z)octadec-12-enoate

Formula: C19H36O2

Spectral Data

cis-12-Octadecenoic 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 2677
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods NSI
Analyzers FT
Last Modification 7/26/2017 12:35:48 PM
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Identificators

InChI InChI=1S/C19H36O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19(20)21-2/h7-8H,3-6,9-18H2,1-2H3/b8-7-
InChI Key LMWAESDDOGRMOK-FPLPWBNLSA-N
Canonical SMILES CCCCCC=CCCCCCCCCCCC(=O)OC
CAS 2733860
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Other Names (Z)-12-Octadecenoic acid methyl ester;
(Z)-Methyl octadec-12-enoate;
Methyl (12Z)octadec-12-enoate

In Other Databases

PubChem 12963317
ChemSpider 21467758