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5-((3-(4-chlorophenyl)prop-2-ynyl)oxy)-2-methylpent-3-yn-2-yl methyl carbonate
SpectraBase Compound ID 5CPlrPj6ukV
InChI InChI=1S/C17H17ClO4/c1-17(2,22-16(19)20-3)11-5-13-21-12-4-6-14-7-9-15(18)10-8-14/h7-10H,12-13H2,1-3H3
InChIKey ACQNJPFTABMGNP-UHFFFAOYSA-N
Mol Weight 320.77 g/mol
Molecular Formula C17H17ClO4
Exact Mass 320.081537 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HO9OmOCGijL
Name 5-((3-(4-chlorophenyl)prop-2-ynyl)oxy)-2-methylpent-3-yn-2-yl methyl carbonate
Appearance Liquid
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Exact Mass 320.081536723 u
Formula C17H17ClO4
InChI InChI=1S/C17H17ClO4/c1-17(2,22-16(19)20-3)11-5-13-21-12-4-6-14-7-9-15(18)10-8-14/h7-10H,12-13H2,1-3H3
InChIKey ACQNJPFTABMGNP-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/chem.201503278
Molecular Weight 320.772 g/mol
Quality 4
SMILES C(OCC#CC(C)(OC(OC)=O)C)C#CC=1C=CC(=CC1)Cl
SPLASH splash10-0002-0900000000-595b491ccd1c37011ab7
Source of Spectrum QE-21-SM9-1h (DOI: 10.1002/chem.201503278)
Wiley ID 1907252