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(E)-Methyl 4-hydroxydodec-5-en-2-ynoate
SpectraBase Compound ID HWx6a2QNwTJ
InChI InChI=1S/C13H20O3/c1-3-4-5-6-7-8-9-12(14)10-11-13(15)16-2/h8-9,12,14H,3-7H2,1-2H3/b9-8+
InChIKey QIZITHBBHZSZBF-CMDGGOBGSA-N
Mol Weight 224.3 g/mol
Molecular Formula C13H20O3
Exact Mass 224.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5w2DhsahIYP
Name (E)-Methyl 4-hydroxydodec-5-en-2-ynoate
Alternate Name(s) Methyl (E)-4-hydroxydodec-5-en-2-ynoate
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Formula C13H20O3
InChI InChI=1S/C13H20O3/c1-3-4-5-6-7-8-9-12(14)10-11-13(15)16-2/h8-9,12,14H,3-7H2,1-2H3/b9-8+
InChIKey QIZITHBBHZSZBF-CMDGGOBGSA-N
Literature Reference DOI 10.1016/j.tetasy.2016.03.009
Molecular Weight 224.300 g/mol
SMILES OC(C#CC(=O)OC)\C=C\CCCCCC
SPLASH splash10-0a4i-9900000000-3130a2e1090d8cfa1146
Source of Spectrum QC-27-435-435_3
Wiley ID 1805727