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(E,13S)-13-hydroxyoctadec-11-en-9-ynoic acid
SpectraBase Compound ID 5vBSSaOtLZ5
InChI InChI=1S/C18H30O3/c1-2-3-11-14-17(19)15-12-9-7-5-4-6-8-10-13-16-18(20)21/h12,15,17,19H,2-6,8,10-11,13-14,16H2,1H3,(H,20,21)/b15-12+/t17-/m0/s1
InChIKey FYPCNVCBWHQKJO-VMEIHUARSA-N
Mol Weight 294.43 g/mol
Molecular Formula C18H30O3
Exact Mass 294.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DZ8fOTfkgmP
Name (E,13S)-13-hydroxyoctadec-11-en-9-ynoic acid
Alternate Name(s) (E,13S)-13-oxidanyloctadec-11-en-9-ynoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H30O3
InChI InChI=1S/C18H30O3/c1-2-3-11-14-17(19)15-12-9-7-5-4-6-8-10-13-16-18(20)21/h12,15,17,19H,2-6,8,10-11,13-14,16H2,1H3,(H,20,21)/b15-12+/t17-/m0/s1
InChIKey FYPCNVCBWHQKJO-VMEIHUARSA-N
Molecular Weight 294.435 g/mol
SMILES OC(CCCCCCCC#C\C=C\[C@@](O)(CCCCC)[H])=O
SPLASH splash10-0006-9200000000-7f5bca95d10a5e59ed02
Source of Spectrum F-56-330-8
Wiley ID 855598