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METHYL_Z,Z,Z-OCTADECA-9,12,15-TRIENOATE;(ALPHA-LINOLENIC-METHYLESTER)
SpectraBase Compound ID DvjIeSQgvHS
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/h4-5,7-8,10-11H,3,6,9,12-18H2,1-2H3/b5-4-,8-7-,11-10-
InChIKey DVWSXZIHSUZZKJ-YSTUJMKBSA-N
Mol Weight 292.5 g/mol
Molecular Formula C19H32O2
Exact Mass 292.24023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1D18UwBMnDM
Name 9,12,15-Octadecatrienoic acid methyl ester-(Z,Z,Z)
Alternate Name(s) Linolenic acid methyl ester
Comments GC-MS analysis for YPTJ (Yupantuojin)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H32O2
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/h4-5,7-8,10-11H,3,6,9,12-18H2,1-2H3/b5-4-,8-7-,11-10-
InChIKey DVWSXZIHSUZZKJ-YSTUJMKBSA-N
Instrument Name Agilent 6890 N-5973
Ionization Type EI
Literature Reference DOI 10.1002/cbdv.202000469
SMILES C(CCCCCCC\C=C/C\C=C/C\C=C/CC)(=O)OC
SPLASH splash10-05po-9400000000-a294b31b7bbf1601cf4f
Source of Spectrum CBD-17-SM36-36-1
Wiley ID 1855874