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(E)-methyl 3-(3-methyl-1-phenylpent-1-yn-3-yloxy)acrylate
SpectraBase Compound ID 8CnSjI1aRX2
InChI InChI=1S/C16H18O3/c1-4-16(2,19-13-11-15(17)18-3)12-10-14-8-6-5-7-9-14/h5-9,11,13H,4H2,1-3H3/b13-11+
InChIKey CSGAUXKLXGVZSB-ACCUITESSA-N
Mol Weight 258.32 g/mol
Molecular Formula C16H18O3
Exact Mass 258.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KyRdUBS1DZd
Name (E)-methyl 3-(3-methyl-1-phenylpent-1-yn-3-yloxy)acrylate
Appearance Colorless liquid
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Exact Mass 258.125594437 u
Formula C16H18O3
InChI InChI=1S/C16H18O3/c1-4-16(2,19-13-11-15(17)18-3)12-10-14-8-6-5-7-9-14/h5-9,11,13H,4H2,1-3H3/b13-11+
InChIKey CSGAUXKLXGVZSB-ACCUITESSA-N
Instrument Name Hewlett-Packard 5995
Ionization Type EI
Literature Reference DOI 10.1002/chem.201503171
Molecular Weight 258.317 g/mol
Quality 168
Reported Formula C16H18O3
SMILES C(C#CC1=CC=CC=C1)(O\C=C\C(OC)=O)(C)CC
SPLASH splash10-056u-1930000000-cc36bb6a0b3f5fd658bd
Source of Spectrum QE-21-SM6-1aa (DOI: 10.1002/chem.201503171)
Wiley ID 1907462