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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 7yNgQI5EQqk
Name Linolenic acid ME
CAS Registry Number 301-00-8
Classification Fatty acid
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 292.240230268 u
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
Ionization Type Electron Ionization (EI)
Molecular Weight 292.463 g/mol
SMILES C(\C=C/CC)\C=C/C\C=C/CCCCCCCC(OC)=O
SPLASH splash10-05pp-9410000000-159b2c1ab07382a6cd28
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
Wiley ID MMPW6e_2668