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[1-[(9Z,11E)-13-oxo-octadecadienoyl]-glycerol]
SpectraBase Compound ID 2HkhNB5fZl0
InChI InChI=1S/C21H36O5/c1-2-3-11-14-19(23)15-12-9-7-5-4-6-8-10-13-16-21(25)26-18-20(24)17-22/h7,9,12,15,20,22,24H,2-6,8,10-11,13-14,16-18H2,1H3/b9-7-,15-12+
InChIKey BABFYBAGZXSUDH-BSZOFBHHSA-N
Mol Weight 368.5 g/mol
Molecular Formula C21H36O5
Exact Mass 368.256274 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4IZJF3cXXth
Name [1-[(9Z,11E)-13-oxo-octadecadienoyl]-glycerol]
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H36O5
InChI InChI=1S/C21H36O5/c1-2-3-11-14-19(23)15-12-9-7-5-4-6-8-10-13-16-21(25)26-18-20(24)17-22/h7,9,12,15,20,22,24H,2-6,8,10-11,13-14,16-18H2,1H3/b9-7-,15-12+
InChIKey BABFYBAGZXSUDH-BSZOFBHHSA-N
Ionization Type EI
Molecular Weight 368.514 g/mol
SMILES OC(CO)COC(CCCCCCC\C=C/C=C/C(CCCCC)=O)=O
SPLASH splash10-0fwa-9773000000-1277848b597c3f7a02a3
Source of Spectrum JP5144540B2
Wiley ID 1852350