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17-Octadecene-9,11-diynoic acid, 8-oxo-, methyl ester
SpectraBase Compound ID ALgHZ58iFlm
InChI InChI=1S/C19H26O3/c1-3-4-5-6-7-8-9-12-15-18(20)16-13-10-11-14-17-19(21)22-2/h3H,1,4-7,10-11,13-14,16-17H2,2H3
InChIKey XXDZFPWYPIWNOF-UHFFFAOYSA-N
Mol Weight 302.41 g/mol
Molecular Formula C19H26O3
Exact Mass 302.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 21ye7v19cEg
Name 17-Octadecene-9,11-diynoic acid, 8-oxo-, methyl ester
Alternate Name(s) Methyl 8-oxo-17-octadecene-9,11-diynoate 8-ketooctadec-17-en-9,11-diynoic acid methyl ester 8-Oxooctadec-17-en-9,11-diynoic acid methyl ester Methyl 8-oxidanylideneoctadec-17-en-9,11-diynoate Methyl 8-oxooctadec-17-en-9,11-diynoate
CAS Registry Number 75112-83-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H26O3
InChI InChI=1S/C19H26O3/c1-3-4-5-6-7-8-9-12-15-18(20)16-13-10-11-14-17-19(21)22-2/h3H,1,4-7,10-11,13-14,16-17H2,2H3
InChIKey XXDZFPWYPIWNOF-UHFFFAOYSA-N
Molecular Weight 302.414 g/mol
SMILES C(C(C#CC#CCCCCC=C)=O)CCCCCC(OC)=O
SPLASH splash10-05nf-3900000000-8ba647e477201b2607b6
Source of Spectrum W5-27245-0-0
Wiley ID 1304947